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34 similar compounds to monomer 50077269

Compile data set for download or QSAR
Wt: 1178.8
BDBM50077282
Wt: 1163.8
BDBM50077280
Wt: 1257.2
BDBM50077281
Wt: 1257.2
BDBM50077286
Wt: 1163.8
BDBM50077292
Wt: 1162.8
BDBM50077308
Wt: 1130.7
BDBM50141027
Wt: 1286.8
BDBM50243570
Wt: 1250.8
BDBM50243571
Wt: 1236.8
BDBM50243572
Wt: 1238.8
BDBM50243573
Wt: 1178.8
BDBM50243515
Wt: 1192.8
BDBM50243516
Wt: 1238.8
BDBM50243574
Wt: 1128.7
BDBM50243519
Displayed 1 to 15 (of 34 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 78 hits for monomerid = 50077282,50077280,50077281,50077286,50077292,50077308,50141027,50243570,50243571,50243572,50243573,50243515,50243516,50243574,50243519   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50243516
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-4-{[(1S)-1...)
Show SMILES CNCCCC[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H70ClN11O10S2/c1-33(72)51-59(81)70-50(57(79)66-46(52(62)74)28-36-14-19-37-9-3-4-10-38(37)25-36)32-83-82-31-49(69-53(75)43(61)26-34-15-20-40(60)21-16-34)58(80)67-47(27-35-17-22-41(73)23-18-35)55(77)68-48(29-39-30-64-44-12-6-5-11-42(39)44)56(78)65-45(54(76)71-51)13-7-8-24-63-2/h3-6,9-12,14-23,25,30,33,43,45-51,63-64,72-73H,7-8,13,24,26-29,31-32,61H2,1-2H3,(H2,62,74)(H,65,78)(H,66,79)(H,67,80)(H,68,77)(H,69,75)(H,70,81)(H,71,76)/t33-,43-,45+,46+,47+,48-,49-,50+,51+/s2
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5.51n/an/an/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Binding affinity to human cloned sst2 receptor


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50077282
PNG
(CHEMBL2311098 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Tle-...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42+,44+,45+,46+,47-,48-,49+,50+/m1/s1
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12n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 2


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50077280
PNG
(CHEMBL408347 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Thr-C...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)25-34-15-18-36-10-2-3-11-37(36)23-34)31-81-80-30-47(68-51(73)41(60)24-33-16-19-39(58)20-17-33)56(78)66-45(26-35-9-8-22-62-28-35)53(75)67-46(27-38-29-63-42-13-5-4-12-40(38)42)54(76)64-43(52(74)70-49)14-6-7-21-59/h2-5,8-13,15-20,22-23,28-29,32,41,43-49,63,71H,6-7,14,21,24-27,30-31,59-60H2,1H3,(H2,61,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46-,47+,48+,49+/m1/s1
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12n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 2


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50243515
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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26n/an/an/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Binding affinity to human cloned sst2 receptor


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50077281
PNG
(CHEMBL438726 | H-Pfp-cyclo[DCys-D2Pal-DTrp-Lys-Val...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33+,34-,35+,46+/m0/s1
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34n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 1


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50077280
PNG
(CHEMBL408347 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Thr-C...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)25-34-15-18-36-10-2-3-11-37(36)23-34)31-81-80-30-47(68-51(73)41(60)24-33-16-19-39(58)20-17-33)56(78)66-45(26-35-9-8-22-62-28-35)53(75)67-46(27-38-29-63-42-13-5-4-12-40(38)42)54(76)64-43(52(74)70-49)14-6-7-21-59/h2-5,8-13,15-20,22-23,28-29,32,41,43-49,63,71H,6-7,14,21,24-27,30-31,59-60H2,1H3,(H2,61,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46-,47+,48+,49+/m1/s1
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38n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 3


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243515
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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48n/an/an/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Binding affinity to human cloned sst5 receptor


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243516
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-4-{[(1S)-1...)
Show SMILES CNCCCC[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H70ClN11O10S2/c1-33(72)51-59(81)70-50(57(79)66-46(52(62)74)28-36-14-19-37-9-3-4-10-38(37)25-36)32-83-82-31-49(69-53(75)43(61)26-34-15-20-40(60)21-16-34)58(80)67-47(27-35-17-22-41(73)23-18-35)55(77)68-48(29-39-30-64-44-12-6-5-11-42(39)44)56(78)65-45(54(76)71-51)13-7-8-24-63-2/h3-6,9-12,14-23,25,30,33,43,45-51,63-64,72-73H,7-8,13,24,26-29,31-32,61H2,1-2H3,(H2,62,74)(H,65,78)(H,66,79)(H,67,80)(H,68,77)(H,69,75)(H,70,81)(H,71,76)/t33-,43-,45+,46+,47+,48-,49-,50+,51+/s2
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50n/an/an/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Binding affinity to human cloned sst5 receptor


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50243516
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-4-{[(1S)-1...)
Show SMILES CNCCCC[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H70ClN11O10S2/c1-33(72)51-59(81)70-50(57(79)66-46(52(62)74)28-36-14-19-37-9-3-4-10-38(37)25-36)32-83-82-31-49(69-53(75)43(61)26-34-15-20-40(60)21-16-34)58(80)67-47(27-35-17-22-41(73)23-18-35)55(77)68-48(29-39-30-64-44-12-6-5-11-42(39)44)56(78)65-45(54(76)71-51)13-7-8-24-63-2/h3-6,9-12,14-23,25,30,33,43,45-51,63-64,72-73H,7-8,13,24,26-29,31-32,61H2,1-2H3,(H2,62,74)(H,65,78)(H,66,79)(H,67,80)(H,68,77)(H,69,75)(H,70,81)(H,71,76)/t33-,43-,45+,46+,47+,48-,49-,50+,51+/s2
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50n/an/an/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Binding affinity to human cloned sst3 receptor


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50077308
PNG
(10-(4-Amino-butyl)-19-[2-amino-3-(4-chloro-phenyl)...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O9S2/c1-33(71)50-58(79)69-49(56(77)65-45(51(62)72)28-36-18-21-37-13-5-6-14-38(37)25-36)32-81-80-31-48(68-52(73)42(61)26-35-19-22-40(59)23-20-35)57(78)66-46(27-34-11-3-2-4-12-34)54(75)67-47(29-39-30-63-43-16-8-7-15-41(39)43)55(76)64-44(53(74)70-50)17-9-10-24-60/h2-8,11-16,18-23,25,30,33,42,44-50,63,71H,9-10,17,24,26-29,31-32,60-61H2,1H3,(H2,62,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t33-,42+,44+,45+,46+,47-,48+,49+,50+/m1/s1
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51n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 2


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50077308
PNG
(10-(4-Amino-butyl)-19-[2-amino-3-(4-chloro-phenyl)...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O9S2/c1-33(71)50-58(79)69-49(56(77)65-45(51(62)72)28-36-18-21-37-13-5-6-14-38(37)25-36)32-81-80-31-48(68-52(73)42(61)26-35-19-22-40(59)23-20-35)57(78)66-46(27-34-11-3-2-4-12-34)54(75)67-47(29-39-30-63-43-16-8-7-15-41(39)43)55(76)64-44(53(74)70-50)17-9-10-24-60/h2-8,11-16,18-23,25,30,33,42,44-50,63,71H,9-10,17,24,26-29,31-32,60-61H2,1H3,(H2,62,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t33-,42+,44+,45+,46+,47-,48+,49+,50+/m1/s1
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87n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 5


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50077281
PNG
(CHEMBL438726 | H-Pfp-cyclo[DCys-D2Pal-DTrp-Lys-Val...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33+,34-,35+,46+/m0/s1
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93n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 3


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50243515
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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93n/an/an/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Binding affinity to human cloned sst3 receptor


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50077282
PNG
(CHEMBL2311098 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Tle-...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42+,44+,45+,46+,47-,48-,49+,50+/m1/s1
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100n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 3


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50077292
PNG
(CHEMBL385745 | H-Cpa-cyclo[DCys-D2Pal-DTrp-Lys-Thr...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)26-34-16-19-35-10-2-3-11-36(35)24-34)31-81-80-30-47(68-51(73)41(60)25-33-17-20-38(58)21-18-33)56(78)67-46(28-39-12-7-9-23-62-39)54(76)66-45(27-37-29-63-42-14-5-4-13-40(37)42)53(75)64-43(52(74)70-49)15-6-8-22-59/h2-5,7,9-14,16-21,23-24,29,32,41,43-49,63,71H,6,8,15,22,25-28,30-31,59-60H2,1H3,(H2,61,72)(H,64,75)(H,65,77)(H,66,76)(H,67,78)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46+,47+,48+,49+/m1/s1
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108n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 3


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50077280
PNG
(CHEMBL408347 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Thr-C...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)25-34-15-18-36-10-2-3-11-37(36)23-34)31-81-80-30-47(68-51(73)41(60)24-33-16-19-39(58)20-17-33)56(78)66-45(26-35-9-8-22-62-28-35)53(75)67-46(27-38-29-63-42-13-5-4-12-40(38)42)54(76)64-43(52(74)70-49)14-6-7-21-59/h2-5,8-13,15-20,22-23,28-29,32,41,43-49,63,71H,6-7,14,21,24-27,30-31,59-60H2,1H3,(H2,61,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46-,47+,48+,49+/m1/s1
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140n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 5


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50077286
PNG
(CHEMBL437057 | H-Pfp-cyclo[DCys-2Pal-DTrp-Lys-Val-...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33-,34-,35+,46+/m0/s1
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170n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 3


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50077292
PNG
(CHEMBL385745 | H-Cpa-cyclo[DCys-D2Pal-DTrp-Lys-Thr...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)26-34-16-19-35-10-2-3-11-36(35)24-34)31-81-80-30-47(68-51(73)41(60)25-33-17-20-38(58)21-18-33)56(78)67-46(28-39-12-7-9-23-62-39)54(76)66-45(27-37-29-63-42-14-5-4-13-40(37)42)53(75)64-43(52(74)70-49)15-6-8-22-59/h2-5,7,9-14,16-21,23-24,29,32,41,43-49,63,71H,6,8,15,22,25-28,30-31,59-60H2,1H3,(H2,61,72)(H,64,75)(H,65,77)(H,66,76)(H,67,78)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46+,47+,48+,49+/m1/s1
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204n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 5


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50077292
PNG
(CHEMBL385745 | H-Cpa-cyclo[DCys-D2Pal-DTrp-Lys-Thr...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)26-34-16-19-35-10-2-3-11-36(35)24-34)31-81-80-30-47(68-51(73)41(60)25-33-17-20-38(58)21-18-33)56(78)67-46(28-39-12-7-9-23-62-39)54(76)66-45(27-37-29-63-42-14-5-4-13-40(37)42)53(75)64-43(52(74)70-49)15-6-8-22-59/h2-5,7,9-14,16-21,23-24,29,32,41,43-49,63,71H,6,8,15,22,25-28,30-31,59-60H2,1H3,(H2,61,72)(H,64,75)(H,65,77)(H,66,76)(H,67,78)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46+,47+,48+,49+/m1/s1
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233n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 2


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50077308
PNG
(10-(4-Amino-butyl)-19-[2-amino-3-(4-chloro-phenyl)...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O9S2/c1-33(71)50-58(79)69-49(56(77)65-45(51(62)72)28-36-18-21-37-13-5-6-14-38(37)25-36)32-81-80-31-48(68-52(73)42(61)26-35-19-22-40(59)23-20-35)57(78)66-46(27-34-11-3-2-4-12-34)54(75)67-47(29-39-30-63-43-16-8-7-15-41(39)43)55(76)64-44(53(74)70-50)17-9-10-24-60/h2-8,11-16,18-23,25,30,33,42,44-50,63,71H,9-10,17,24,26-29,31-32,60-61H2,1H3,(H2,62,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t33-,42+,44+,45+,46+,47-,48+,49+,50+/m1/s1
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290n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 3


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50077308
PNG
(10-(4-Amino-butyl)-19-[2-amino-3-(4-chloro-phenyl)...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O9S2/c1-33(71)50-58(79)69-49(56(77)65-45(51(62)72)28-36-18-21-37-13-5-6-14-38(37)25-36)32-81-80-31-48(68-52(73)42(61)26-35-19-22-40(59)23-20-35)57(78)66-46(27-34-11-3-2-4-12-34)54(75)67-47(29-39-30-63-43-16-8-7-15-41(39)43)55(76)64-44(53(74)70-50)17-9-10-24-60/h2-8,11-16,18-23,25,30,33,42,44-50,63,71H,9-10,17,24,26-29,31-32,60-61H2,1H3,(H2,62,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t33-,42+,44+,45+,46+,47-,48+,49+,50+/m1/s1
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443n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 1


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50077282
PNG
(CHEMBL2311098 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Tle-...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42+,44+,45+,46+,47-,48-,49+,50+/m1/s1
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520n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 5


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50077286
PNG
(CHEMBL437057 | H-Pfp-cyclo[DCys-2Pal-DTrp-Lys-Val-...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33-,34-,35+,46+/m0/s1
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568n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 1


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50077281
PNG
(CHEMBL438726 | H-Pfp-cyclo[DCys-D2Pal-DTrp-Lys-Val...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33+,34-,35+,46+/m0/s1
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692n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 2


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50077282
PNG
(CHEMBL2311098 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Tle-...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42+,44+,45+,46+,47-,48-,49+,50+/m1/s1
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895n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 4


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50077286
PNG
(CHEMBL437057 | H-Pfp-cyclo[DCys-2Pal-DTrp-Lys-Val-...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33-,34-,35+,46+/m0/s1
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918n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 5


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50077280
PNG
(CHEMBL408347 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Thr-C...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)25-34-15-18-36-10-2-3-11-37(36)23-34)31-81-80-30-47(68-51(73)41(60)24-33-16-19-39(58)20-17-33)56(78)66-45(26-35-9-8-22-62-28-35)53(75)67-46(27-38-29-63-42-13-5-4-12-40(38)42)54(76)64-43(52(74)70-49)14-6-7-21-59/h2-5,8-13,15-20,22-23,28-29,32,41,43-49,63,71H,6-7,14,21,24-27,30-31,59-60H2,1H3,(H2,61,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46-,47+,48+,49+/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 4


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50077282
PNG
(CHEMBL2311098 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Tle-...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42+,44+,45+,46+,47-,48-,49+,50+/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 1


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50077286
PNG
(CHEMBL437057 | H-Pfp-cyclo[DCys-2Pal-DTrp-Lys-Val-...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33-,34-,35+,46+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 2


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50077308
PNG
(10-(4-Amino-butyl)-19-[2-amino-3-(4-chloro-phenyl)...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C58H68ClN11O9S2/c1-33(71)50-58(79)69-49(56(77)65-45(51(62)72)28-36-18-21-37-13-5-6-14-38(37)25-36)32-81-80-31-48(68-52(73)42(61)26-35-19-22-40(59)23-20-35)57(78)66-46(27-34-11-3-2-4-12-34)54(75)67-47(29-39-30-63-43-16-8-7-15-41(39)43)55(76)64-44(53(74)70-50)17-9-10-24-60/h2-8,11-16,18-23,25,30,33,42,44-50,63,71H,9-10,17,24,26-29,31-32,60-61H2,1H3,(H2,62,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t33-,42+,44+,45+,46+,47-,48+,49+,50+/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 4


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50077281
PNG
(CHEMBL438726 | H-Pfp-cyclo[DCys-D2Pal-DTrp-Lys-Val...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O)NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C54H58F10N12O8S2/c1-22(2)46-54(84)75-35(52(82)71-31(47(67)77)18-27-38(57)42(61)45(64)43(62)39(27)58)21-86-85-20-34(74-48(78)28(66)17-26-36(55)40(59)44(63)41(60)37(26)56)53(83)73-33(16-24-9-6-8-14-68-24)51(81)72-32(15-23-19-69-29-11-4-3-10-25(23)29)50(80)70-30(49(79)76-46)12-5-7-13-65/h3-4,6,8-11,14,19,22,28,30-35,46,69H,5,7,12-13,15-18,20-21,65-66H2,1-2H3,(H2,67,77)(H,70,80)(H,71,82)(H,72,81)(H,73,83)(H,74,78)(H,75,84)(H,76,79)/t28-,30-,31-,32+,33+,34-,35+,46+/m0/s1
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1.38E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 5


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50077280
PNG
(CHEMBL408347 | H-Cpa-cyclo[DCys-Pal-DTrp-Lys-Thr-C...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)25-34-15-18-36-10-2-3-11-37(36)23-34)31-81-80-30-47(68-51(73)41(60)24-33-16-19-39(58)20-17-33)56(78)66-45(26-35-9-8-22-62-28-35)53(75)67-46(27-38-29-63-42-13-5-4-12-40(38)42)54(76)64-43(52(74)70-49)14-6-7-21-59/h2-5,8-13,15-20,22-23,28-29,32,41,43-49,63,71H,6-7,14,21,24-27,30-31,59-60H2,1H3,(H2,61,72)(H,64,76)(H,65,77)(H,66,78)(H,67,75)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46-,47+,48+,49+/m1/s1
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1.40E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 1


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50077292
PNG
(CHEMBL385745 | H-Cpa-cyclo[DCys-D2Pal-DTrp-Lys-Thr...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccn2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C57H67ClN12O9S2/c1-32(71)49-57(79)69-48(55(77)65-44(50(61)72)26-34-16-19-35-10-2-3-11-36(35)24-34)31-81-80-30-47(68-51(73)41(60)25-33-17-20-38(58)21-18-33)56(78)67-46(28-39-12-7-9-23-62-39)54(76)66-45(27-37-29-63-42-14-5-4-13-40(37)42)53(75)64-43(52(74)70-49)15-6-8-22-59/h2-5,7,9-14,16-21,23-24,29,32,41,43-49,63,71H,6,8,15,22,25-28,30-31,59-60H2,1H3,(H2,61,72)(H,64,75)(H,65,77)(H,66,76)(H,67,78)(H,68,73)(H,69,79)(H,70,74)/t32-,41+,43+,44+,45-,46+,47+,48+,49+/m1/s1
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1.69E+3n/an/an/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against human Somatostatin receptor type 1


J Med Chem 42: 1863-71 (1999)


Article DOI: 10.1021/jm9806289
BindingDB Entry DOI: 10.7270/Q2XW4J03
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50141027
PNG
(1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...)
Show SMILES C[C@H](O)[C@@H](NC(=O)[C@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1)C(N)=O
Show InChI InChI=1S/C51H64ClN15O9S2/c1-27(68)42(43(54)69)67-50(76)41-25-78-77-24-40(65-44(70)34(53)18-28-8-3-2-4-9-28)49(75)64-39(21-32-23-57-26-60-32)48(74)62-37(19-29-13-15-31(52)16-14-29)46(72)61-36(12-7-17-58-51(55)56)45(71)63-38(47(73)66-41)20-30-22-59-35-11-6-5-10-33(30)35/h2-6,8-11,13-16,22-23,26-27,34,36-42,59,68H,7,12,17-21,24-25,53H2,1H3,(H2,54,69)(H,57,60)(H,61,72)(H,62,74)(H,63,71)(H,64,75)(H,65,70)(H,66,73)(H,67,76)(H4,55,56,58)/t27-,34+,36-,37-,38+,39-,40-,41+,42+/m0/s1
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n/an/an/an/a 0.670n/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Effective concentration for maximum agonist response towards mouse melanocortin 4 receptor


J Med Chem 47: 1514-26 (2004)


Article DOI: 10.1021/jm030452x
BindingDB Entry DOI: 10.7270/Q2XP75PK
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Rattus norvegicus)
BDBM50141027
PNG
(1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...)
Show SMILES C[C@H](O)[C@@H](NC(=O)[C@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1)C(N)=O
Show InChI InChI=1S/C51H64ClN15O9S2/c1-27(68)42(43(54)69)67-50(76)41-25-78-77-24-40(65-44(70)34(53)18-28-8-3-2-4-9-28)49(75)64-39(21-32-23-57-26-60-32)48(74)62-37(19-29-13-15-31(52)16-14-29)46(72)61-36(12-7-17-58-51(55)56)45(71)63-38(47(73)66-41)20-30-22-59-35-11-6-5-10-33(30)35/h2-6,8-11,13-16,22-23,26-27,34,36-42,59,68H,7,12,17-21,24-25,53H2,1H3,(H2,54,69)(H,57,60)(H,61,72)(H,62,74)(H,63,71)(H,64,75)(H,65,70)(H,66,73)(H,67,76)(H4,55,56,58)/t27-,34+,36-,37-,38+,39-,40-,41+,42+/m0/s1
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n/an/an/an/a 7.30n/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Maximal agonist response at rat melanocortin 3 receptor (MC3R)


J Med Chem 47: 1514-26 (2004)


Article DOI: 10.1021/jm030452x
BindingDB Entry DOI: 10.7270/Q2XP75PK
More data for this
Ligand-Target Pair
Melanocortin receptor 1


(Mus musculus)
BDBM50141027
PNG
(1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...)
Show SMILES C[C@H](O)[C@@H](NC(=O)[C@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1)C(N)=O
Show InChI InChI=1S/C51H64ClN15O9S2/c1-27(68)42(43(54)69)67-50(76)41-25-78-77-24-40(65-44(70)34(53)18-28-8-3-2-4-9-28)49(75)64-39(21-32-23-57-26-60-32)48(74)62-37(19-29-13-15-31(52)16-14-29)46(72)61-36(12-7-17-58-51(55)56)45(71)63-38(47(73)66-41)20-30-22-59-35-11-6-5-10-33(30)35/h2-6,8-11,13-16,22-23,26-27,34,36-42,59,68H,7,12,17-21,24-25,53H2,1H3,(H2,54,69)(H,57,60)(H,61,72)(H,62,74)(H,63,71)(H,64,75)(H,65,70)(H,66,73)(H,67,76)(H4,55,56,58)/t27-,34+,36-,37-,38+,39-,40-,41+,42+/m0/s1
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n/an/an/an/a 0.370n/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Maximal agonist response of mouse melanocortin 1 receptor (MC1R)


J Med Chem 47: 1514-26 (2004)


Article DOI: 10.1021/jm030452x
BindingDB Entry DOI: 10.7270/Q2XP75PK
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50141027
PNG
(1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...)
Show SMILES C[C@H](O)[C@@H](NC(=O)[C@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1)C(N)=O
Show InChI InChI=1S/C51H64ClN15O9S2/c1-27(68)42(43(54)69)67-50(76)41-25-78-77-24-40(65-44(70)34(53)18-28-8-3-2-4-9-28)49(75)64-39(21-32-23-57-26-60-32)48(74)62-37(19-29-13-15-31(52)16-14-29)46(72)61-36(12-7-17-58-51(55)56)45(71)63-38(47(73)66-41)20-30-22-59-35-11-6-5-10-33(30)35/h2-6,8-11,13-16,22-23,26-27,34,36-42,59,68H,7,12,17-21,24-25,53H2,1H3,(H2,54,69)(H,57,60)(H,61,72)(H,62,74)(H,63,71)(H,64,75)(H,65,70)(H,66,73)(H,67,76)(H4,55,56,58)/t27-,34+,36-,37-,38+,39-,40-,41+,42+/m0/s1
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n/an/an/an/a 30n/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Effective concentration required for maximum agonist response at melanocortin 1 receptor from frog skin.


J Med Chem 47: 1514-26 (2004)


Article DOI: 10.1021/jm030452x
BindingDB Entry DOI: 10.7270/Q2XP75PK
More data for this
Ligand-Target Pair
Melanocortin receptor 5 (MC5R)


(Mus musculus (Mouse))
BDBM50141027
PNG
(1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...)
Show SMILES C[C@H](O)[C@@H](NC(=O)[C@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1)C(N)=O
Show InChI InChI=1S/C51H64ClN15O9S2/c1-27(68)42(43(54)69)67-50(76)41-25-78-77-24-40(65-44(70)34(53)18-28-8-3-2-4-9-28)49(75)64-39(21-32-23-57-26-60-32)48(74)62-37(19-29-13-15-31(52)16-14-29)46(72)61-36(12-7-17-58-51(55)56)45(71)63-38(47(73)66-41)20-30-22-59-35-11-6-5-10-33(30)35/h2-6,8-11,13-16,22-23,26-27,34,36-42,59,68H,7,12,17-21,24-25,53H2,1H3,(H2,54,69)(H,57,60)(H,61,72)(H,62,74)(H,63,71)(H,64,75)(H,65,70)(H,66,73)(H,67,76)(H4,55,56,58)/t27-,34+,36-,37-,38+,39-,40-,41+,42+/m0/s1
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n/an/an/an/a 0.110n/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Maximum agonist response for mouse melanocortin 5 receptor (MC5R)


J Med Chem 47: 1514-26 (2004)


Article DOI: 10.1021/jm030452x
BindingDB Entry DOI: 10.7270/Q2XP75PK
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50243516
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-4-{[(1S)-1...)
Show SMILES CNCCCC[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H70ClN11O10S2/c1-33(72)51-59(81)70-50(57(79)66-46(52(62)74)28-36-14-19-37-9-3-4-10-38(37)25-36)32-83-82-31-49(69-53(75)43(61)26-34-15-20-40(60)21-16-34)58(80)67-47(27-35-17-22-41(73)23-18-35)55(77)68-48(29-39-30-64-44-12-6-5-11-42(39)44)56(78)65-45(54(76)71-51)13-7-8-24-63-2/h3-6,9-12,14-23,25,30,33,43,45-51,63-64,72-73H,7-8,13,24,26-29,31-32,61H2,1-2H3,(H2,62,74)(H,65,78)(H,66,79)(H,67,80)(H,68,77)(H,69,75)(H,70,81)(H,71,76)/t33-,43-,45+,46+,47+,48-,49-,50+,51+/s2
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n/an/a 715n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst4 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50243515
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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n/an/a 296n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst4 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243574
PNG
((2R)-2-amino-N-[(4R,7S,10S,13S,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccc(F)cc23)NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H69ClFN13O10S2/c1-31(75)50-58(83)73-49(56(81)69-45(51(64)76)25-34-9-14-35-6-2-3-7-36(35)22-34)30-86-85-29-48(72-52(77)42(63)23-32-10-15-38(60)16-11-32)57(82)70-46(24-33-12-18-40(19-13-33)67-59(65)84)54(79)71-47(26-37-28-66-43-20-17-39(61)27-41(37)43)55(80)68-44(53(78)74-50)8-4-5-21-62/h2-3,6-7,9-20,22,27-28,31,42,44-50,66,75H,4-5,8,21,23-26,29-30,62-63H2,1H3,(H2,64,76)(H,68,80)(H,69,81)(H,70,82)(H,71,79)(H,72,77)(H,73,83)(H,74,78)(H3,65,67,84)/t31-,42-,44+,45+,46+,47+,48-,49+,50+/s2
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n/an/a 618n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243573
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccc(F)cc23)NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H69ClFN13O10S2/c1-31(75)50-58(83)73-49(56(81)69-45(51(64)76)25-34-9-14-35-6-2-3-7-36(35)22-34)30-86-85-29-48(72-52(77)42(63)23-32-10-15-38(60)16-11-32)57(82)70-46(24-33-12-18-40(19-13-33)67-59(65)84)54(79)71-47(26-37-28-66-43-20-17-39(61)27-41(37)43)55(80)68-44(53(78)74-50)8-4-5-21-62/h2-3,6-7,9-20,22,27-28,31,42,44-50,66,75H,4-5,8,21,23-26,29-30,62-63H2,1H3,(H2,64,76)(H,68,80)(H,69,81)(H,70,82)(H,71,79)(H,72,77)(H,73,83)(H,74,78)(H3,65,67,84)/t31-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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n/an/a 94n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243572
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(NC(=O)NO)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H70ClN13O11S2/c1-32(74)50-58(82)71-49(56(80)67-45(51(63)75)27-35-13-18-36-8-2-3-9-37(36)24-35)31-86-85-30-48(70-52(76)42(62)25-33-14-19-39(60)20-15-33)57(81)68-46(26-34-16-21-40(22-17-34)65-59(83)73-84)54(78)69-47(28-38-29-64-43-11-5-4-10-41(38)43)55(79)66-44(53(77)72-50)12-6-7-23-61/h2-5,8-11,13-22,24,29,32,42,44-50,64,74,84H,6-7,12,23,25-28,30-31,61-62H2,1H3,(H2,63,75)(H,66,79)(H,67,80)(H,68,81)(H,69,78)(H,70,76)(H,71,82)(H,72,77)(H2,65,73,83)/t32-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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n/an/a 426n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243571
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES CONC(=O)Nc1ccc(C[C@@H]2NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc3c[nH]c4ccccc34)NC2=O)[C@@H](C)O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(N)=O)NC(=O)[C@H](N)Cc2ccc(Cl)cc2)cc1
Show InChI InChI=1/C60H72ClN13O11S2/c1-33(75)51-59(83)72-50(57(81)68-46(52(64)76)28-36-14-19-37-9-3-4-10-38(37)25-36)32-87-86-31-49(71-53(77)43(63)26-34-15-20-40(61)21-16-34)58(82)69-47(27-35-17-22-41(23-18-35)66-60(84)74-85-2)55(79)70-48(29-39-30-65-44-12-6-5-11-42(39)44)56(80)67-45(54(78)73-51)13-7-8-24-62/h3-6,9-12,14-23,25,30,33,43,45-51,65,75H,7-8,13,24,26-29,31-32,62-63H2,1-2H3,(H2,64,76)(H,67,80)(H,68,81)(H,69,82)(H,70,79)(H,71,77)(H,72,83)(H,73,78)(H2,66,74,84)/t33-,43-,45+,46+,47+,48-,49-,50+,51+/s2
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n/an/a 313n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243570
PNG
(2-[(2R)-2-{[(4R,7S,10S,13R,16S,19S)-19-[(2R)-2-ami...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)NCC(O)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C58H72ClN15O13S2/c1-30(75)48-56(85)73-46(55(84)69-42(50(79)65-27-47(76)77)23-32-11-17-36(18-12-32)66-57(62)86)29-89-88-28-45(72-49(78)39(61)22-31-9-15-35(59)16-10-31)54(83)70-43(24-33-13-19-37(20-14-33)67-58(63)87)52(81)71-44(25-34-26-64-40-7-3-2-6-38(34)40)53(82)68-41(51(80)74-48)8-4-5-21-60/h2-3,6-7,9-20,26,30,39,41-46,48,64,75H,4-5,8,21-25,27-29,60-61H2,1H3,(H,65,79)(H,68,82)(H,69,84)(H,70,83)(H,71,81)(H,72,78)(H,73,85)(H,74,80)(H,76,77)(H3,62,66,86)(H3,63,67,87)/t30-,39-,41+,42-,43+,44-,45-,46+,48+/s2
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n/an/a 810n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243519
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C55H70ClN11O9S2/c1-30(2)22-43-51(72)64-44(26-36-27-60-40-13-7-6-12-38(36)40)52(73)61-41(14-8-9-21-57)50(71)67-47(31(3)68)55(76)66-46(53(74)62-42(48(59)69)25-33-15-18-34-10-4-5-11-35(34)23-33)29-78-77-28-45(54(75)63-43)65-49(70)39(58)24-32-16-19-37(56)20-17-32/h4-7,10-13,15-20,23,27,30-31,39,41-47,60,68H,8-9,14,21-22,24-26,28-29,57-58H2,1-3H3,(H2,59,69)(H,61,73)(H,62,74)(H,63,75)(H,64,72)(H,65,70)(H,66,76)(H,67,71)/t31-,39-,41+,42+,43+,44-,45-,46+,47+/s2
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n/an/a 657n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243516
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-4-{[(1S)-1...)
Show SMILES CNCCCC[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H70ClN11O10S2/c1-33(72)51-59(81)70-50(57(79)66-46(52(62)74)28-36-14-19-37-9-3-4-10-38(37)25-36)32-83-82-31-49(69-53(75)43(61)26-34-15-20-40(60)21-16-34)58(80)67-47(27-35-17-22-41(73)23-18-35)55(77)68-48(29-39-30-64-44-12-6-5-11-42(39)44)56(78)65-45(54(76)71-51)13-7-8-24-63-2/h3-6,9-12,14-23,25,30,33,43,45-51,63-64,72-73H,7-8,13,24,26-29,31-32,61H2,1-2H3,(H2,62,74)(H,65,78)(H,66,79)(H,67,80)(H,68,77)(H,69,75)(H,70,81)(H,71,76)/t33-,43-,45+,46+,47+,48-,49-,50+,51+/s2
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n/an/a 53n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50243515
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C58H68ClN11O10S2/c1-32(71)50-58(80)69-49(56(78)65-45(51(62)73)27-35-13-18-36-8-2-3-9-37(36)24-35)31-82-81-30-48(68-52(74)42(61)25-33-14-19-39(59)20-15-33)57(79)66-46(26-34-16-21-40(72)22-17-34)54(76)67-47(28-38-29-63-43-11-5-4-10-41(38)43)55(77)64-44(53(75)70-50)12-6-7-23-60/h2-5,8-11,13-22,24,29,32,42,44-50,63,71-72H,6-7,12,23,25-28,30-31,60-61H2,1H3,(H2,62,73)(H,64,77)(H,65,78)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,75)/t32-,42-,44+,45+,46+,47-,48-,49+,50+/s2
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n/an/a 218n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50243519
PNG
((2R)-2-amino-N-[(4R,7S,10S,13R,16S,19S)-10-(4-amin...)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C55H70ClN11O9S2/c1-30(2)22-43-51(72)64-44(26-36-27-60-40-13-7-6-12-38(36)40)52(73)61-41(14-8-9-21-57)50(71)67-47(31(3)68)55(76)66-46(53(74)62-42(48(59)69)25-33-15-18-34-10-4-5-11-35(34)23-33)29-78-77-28-45(54(75)63-43)65-49(70)39(58)24-32-16-19-37(56)20-17-32/h4-7,10-13,15-20,23,27,30-31,39,41-47,60,68H,8-9,14,21-22,24-26,28-29,57-58H2,1-3H3,(H2,59,69)(H,61,73)(H,62,74)(H,63,75)(H,64,72)(H,65,70)(H,66,76)(H,67,71)/t31-,39-,41+,42+,43+,44-,45-,46+,47+/s2
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n/an/a 908n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst4 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50243574
PNG
((2R)-2-amino-N-[(4R,7S,10S,13S,16S,19S)-10-(4-amin...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccc(F)cc23)NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1/C59H69ClFN13O10S2/c1-31(75)50-58(83)73-49(56(81)69-45(51(64)76)25-34-9-14-35-6-2-3-7-36(35)22-34)30-86-85-29-48(72-52(77)42(63)23-32-10-15-38(60)16-11-32)57(82)70-46(24-33-12-18-40(19-13-33)67-59(65)84)54(79)71-47(26-37-28-66-43-20-17-39(61)27-41(37)43)55(80)68-44(53(78)74-50)8-4-5-21-62/h2-3,6-7,9-20,22,27-28,31,42,44-50,66,75H,4-5,8,21,23-26,29-30,62-63H2,1H3,(H2,64,76)(H,68,80)(H,69,81)(H,70,82)(H,71,79)(H,72,77)(H,73,83)(H,74,78)(H3,65,67,84)/t31-,42-,44+,45+,46+,47+,48-,49+,50+/s2
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n/an/a>1.00E+3n/an/an/an/an/an/a



University of Berne

Curated by ChEMBL


Assay Description
Displacement of [125I][LTT]SRIF28 from human cloned sst1 receptor by autoradiography


J Med Chem 51: 4030-7 (2008)


Article DOI: 10.1021/jm701618q
BindingDB Entry DOI: 10.7270/Q22J6CSW
More data for this
Ligand-Target Pair
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