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125 similar compounds to monomer 50350840

Compile data set for download or QSAR
Wt: 1007.1
BDBM86210
Purchase
Wt: 1028.2
BDBM50016317
Wt: 1024.2
BDBM50020701
Wt: 1007.1
BDBM50013775
Purchase
Wt: 1042.1
BDBM50016309
Wt: 1014.1
BDBM50016310
Wt: 1029.1
BDBM50016313
Wt: 1028.2
BDBM50016315
Wt: 1056.2
BDBM50016316
Wt: 964.1
BDBM50030077
Wt: 993.1
BDBM50030079
Wt: 1037.2
BDBM50030080
Wt: 1061.2
BDBM50030083
Wt: 1024.2
BDBM50056795
Wt: 992.1
BDBM50056796
Displayed 1 to 15 (of 125 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 49 hits for monomerid = 86210,50016317,50020701,50013775,50016309,50016310,50016313,50016315,50016316,50030077,50030079,50030080,50030083,50056795,50056796   
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
Oxytocin receptor


(HEK293)
BDBM86210
PNG
(CAS_50-56-6 | NSC_439302 | Oxytocin)
Show SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)
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0.5n/an/an/an/an/an/an/an/a



LCG Bioscience

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 253-61 (2003)


Article DOI: 10.1124/jpet.103.049395
BindingDB Entry DOI: 10.7270/Q2MC8XKT
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM86210
PNG
(CAS_50-56-6 | NSC_439302 | Oxytocin)
Show SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)
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0.710n/an/an/an/an/an/an/an/a



LCG Bioscience

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 253-61 (2003)


Article DOI: 10.1124/jpet.103.049395
BindingDB Entry DOI: 10.7270/Q2MC8XKT
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM50013775
PNG
((oxytocin-OT) cyclo[Cys-Tyr-Ile-Gln-Asn-Cys]-Pro-L...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22?,25-,26+,27+,28+,29+,30?,31?,35+/m1/s1
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0.890n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd.

Curated by PDSP Ki Database




J Pharmacol Exp Ther 282: 301-8 (1997)


BindingDB Entry DOI: 10.7270/Q25T3J1N
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM50056796
PNG
(CHEMBL435716 | DEAMINOOXYTOCIN)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H65N11O12S2/c1-5-23(4)36-42(65)49-26(12-13-32(44)56)38(61)50-29(19-33(45)57)39(62)52-30(21-68-67-16-14-35(59)48-28(40(63)53-36)18-24-8-10-25(55)11-9-24)43(66)54-15-6-7-31(54)41(64)51-27(17-22(2)3)37(60)47-20-34(46)58/h8-11,22-23,26-31,36,55H,5-7,12-21H2,1-4H3,(H2,44,56)(H2,45,57)(H2,46,58)(H,47,60)(H,48,59)(H,49,65)(H,50,61)(H,51,64)(H,52,62)(H,53,63)/t23-,26-,27-,28-,29-,30+,31-,36-/m0/s1
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0.900n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Binding affinity against Oxytocin receptor was determined in rat uterine membrane using radioligand [3H]-oxytocin


J Med Chem 40: 864-76 (1997)


Article DOI: 10.1021/jm9607156
BindingDB Entry DOI: 10.7270/Q28P5ZK3
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM86210
PNG
(CAS_50-56-6 | NSC_439302 | Oxytocin)
Show SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)
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1.90n/an/an/an/an/an/an/an/a



LCG Bioscience

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 253-61 (2003)


Article DOI: 10.1124/jpet.103.049395
BindingDB Entry DOI: 10.7270/Q2MC8XKT
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM50056795
PNG
(CHEMBL353396 | Deaminooxytocin Trisulfide)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H65N11O12S3/c1-5-23(4)36-42(65)49-26(12-13-32(44)56)38(61)50-29(19-33(45)57)39(62)52-30(21-68-69-67-16-14-35(59)48-28(40(63)53-36)18-24-8-10-25(55)11-9-24)43(66)54-15-6-7-31(54)41(64)51-27(17-22(2)3)37(60)47-20-34(46)58/h8-11,22-23,26-31,36,55H,5-7,12-21H2,1-4H3,(H2,44,56)(H2,45,57)(H2,46,58)(H,47,60)(H,48,59)(H,49,65)(H,50,61)(H,51,64)(H,52,62)(H,53,63)/t23-,26-,27-,28-,29-,30+,31-,36-/m0/s1
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3n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Binding affinity against Oxytocin receptor was determined in rat uterine membrane using radioligand [3H]-oxytocin


J Med Chem 40: 864-76 (1997)


Article DOI: 10.1021/jm9607156
BindingDB Entry DOI: 10.7270/Q28P5ZK3
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM50056796
PNG
(CHEMBL435716 | DEAMINOOXYTOCIN)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H65N11O12S2/c1-5-23(4)36-42(65)49-26(12-13-32(44)56)38(61)50-29(19-33(45)57)39(62)52-30(21-68-67-16-14-35(59)48-28(40(63)53-36)18-24-8-10-25(55)11-9-24)43(66)54-15-6-7-31(54)41(64)51-27(17-22(2)3)37(60)47-20-34(46)58/h8-11,22-23,26-31,36,55H,5-7,12-21H2,1-4H3,(H2,44,56)(H2,45,57)(H2,46,58)(H,47,60)(H,48,59)(H,49,65)(H,50,61)(H,51,64)(H,52,62)(H,53,63)/t23-,26-,27-,28-,29-,30+,31-,36-/m0/s1
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3.20n/an/an/an/an/an/an/an/a



Université de Montréal

Curated by ChEMBL


Assay Description
Binding affinity of the compound against oxytocin receptor


J Med Chem 43: 1448-55 (2000)


Article DOI: 10.1021/jm990090m
BindingDB Entry DOI: 10.7270/Q22V2FCX
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(Sus scrofa)
BDBM50020701
PNG
(1-(13,16-Dibenzyl-7-carbamoylmethyl-10-isopropyl-6...)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O
Show InChI InChI=1S/C46H65N13O10S2/c1-26(2)38-44(68)56-32(23-35(47)60)41(65)57-33(45(69)59-19-10-16-34(59)43(67)54-29(15-9-18-51-46(49)50)39(63)52-24-36(48)61)25-71-70-20-17-37(62)53-30(21-27-11-5-3-6-12-27)40(64)55-31(42(66)58-38)22-28-13-7-4-8-14-28/h3-8,11-14,26,29-34,38H,9-10,15-25H2,1-2H3,(H2,47,60)(H2,48,61)(H,52,63)(H,53,62)(H,54,67)(H,55,64)(H,56,68)(H,57,65)(H,58,66)(H4,49,50,51)/t29-,30-,31-,32-,33-,34-,38-/m0/s1
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10n/an/an/an/an/an/an/an/a



Smith Kline and French Laboratories

Curated by ChEMBL


Assay Description
Inhibition of LVP-sensitive adenylate cyclase in a pig renal medullary preparation


J Med Chem 31: 742-4 (1988)


Article DOI: 10.1021/jm00399a009
BindingDB Entry DOI: 10.7270/Q2VD6XFS
More data for this
Ligand-Target Pair
Vasopressin receptor


(RAT)
BDBM50013775
PNG
((oxytocin-OT) cyclo[Cys-Tyr-Ile-Gln-Asn-Cys]-Pro-L...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22?,25-,26+,27+,28+,29+,30?,31?,35+/m1/s1
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39.4n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd.

Curated by PDSP Ki Database




J Pharmacol Exp Ther 282: 301-8 (1997)


BindingDB Entry DOI: 10.7270/Q25T3J1N
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50013775
PNG
((oxytocin-OT) cyclo[Cys-Tyr-Ile-Gln-Asn-Cys]-Pro-L...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22?,25-,26+,27+,28+,29+,30?,31?,35+/m1/s1
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46.2n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd.

Curated by PDSP Ki Database




J Pharmacol Exp Ther 282: 301-8 (1997)


BindingDB Entry DOI: 10.7270/Q25T3J1N
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50013775
PNG
((oxytocin-OT) cyclo[Cys-Tyr-Ile-Gln-Asn-Cys]-Pro-L...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22?,25-,26+,27+,28+,29+,30?,31?,35+/m1/s1
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58.4n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd.

Curated by PDSP Ki Database




J Pharmacol Exp Ther 282: 301-8 (1997)


BindingDB Entry DOI: 10.7270/Q25T3J1N
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM86210
PNG
(CAS_50-56-6 | NSC_439302 | Oxytocin)
Show SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)
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123n/an/an/an/an/an/an/an/a



LCG Bioscience

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 253-61 (2003)


Article DOI: 10.1124/jpet.103.049395
BindingDB Entry DOI: 10.7270/Q2MC8XKT
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50013775
PNG
((oxytocin-OT) cyclo[Cys-Tyr-Ile-Gln-Asn-Cys]-Pro-L...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22?,25-,26+,27+,28+,29+,30?,31?,35+/m1/s1
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677n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd.

Curated by PDSP Ki Database




J Pharmacol Exp Ther 282: 301-8 (1997)


BindingDB Entry DOI: 10.7270/Q25T3J1N
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50013775
PNG
((oxytocin-OT) cyclo[Cys-Tyr-Ile-Gln-Asn-Cys]-Pro-L...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22?,25-,26+,27+,28+,29+,30?,31?,35+/m1/s1
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1.01E+3n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd.

Curated by PDSP Ki Database




J Pharmacol Exp Ther 282: 301-8 (1997)


BindingDB Entry DOI: 10.7270/Q25T3J1N
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM86210
PNG
(CAS_50-56-6 | NSC_439302 | Oxytocin)
Show SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)
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1.54E+3n/an/an/an/an/an/an/an/a



LCG Bioscience

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 253-61 (2003)


Article DOI: 10.1124/jpet.103.049395
BindingDB Entry DOI: 10.7270/Q2MC8XKT
More data for this
Ligand-Target Pair
Vasopressin V1b receptor


(Homo sapiens (Human))
BDBM86210
PNG
(CAS_50-56-6 | NSC_439302 | Oxytocin)
Show SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)
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1.78E+3n/an/an/an/an/an/an/an/a



LCG Bioscience

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 253-61 (2003)


Article DOI: 10.1124/jpet.103.049395
BindingDB Entry DOI: 10.7270/Q2MC8XKT
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016317
PNG
(CHEMBL2371674 | [Mpa1Val4MeAla7]AVP (Arginine-vaso...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29-,30+,31-,32-,33-,37+/m0/s1
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n/an/an/a 53n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016317
PNG
(CHEMBL2371674 | [Mpa1Val4MeAla7]AVP (Arginine-vaso...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29-,30+,31-,32-,33-,37+/m0/s1
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n/an/an/a 8.20E+10n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016309
PNG
(CHEMBL410025 | [Phe2Sar7]AVP (Arginine-vasopressin...)
Show SMILES CN(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1
Show InChI InChI=1S/C44H63N15O11S2/c1-59(21-36(63)53-27(13-8-16-51-44(49)50)38(65)52-20-35(48)62)43(70)32-23-72-71-22-26(45)37(64)55-29(17-24-9-4-2-5-10-24)41(68)56-30(18-25-11-6-3-7-12-25)40(67)54-28(14-15-33(46)60)39(66)57-31(19-34(47)61)42(69)58-32/h2-7,9-12,26-32H,8,13-23,45H2,1H3,(H2,46,60)(H2,47,61)(H2,48,62)(H,52,65)(H,53,63)(H,54,67)(H,55,64)(H,56,68)(H,57,66)(H,58,69)(H4,49,50,51)/t26-,27+,28-,29-,30+,31+,32+/m1/s1
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n/an/an/a 170n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016309
PNG
(CHEMBL410025 | [Phe2Sar7]AVP (Arginine-vasopressin...)
Show SMILES CN(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1
Show InChI InChI=1S/C44H63N15O11S2/c1-59(21-36(63)53-27(13-8-16-51-44(49)50)38(65)52-20-35(48)62)43(70)32-23-72-71-22-26(45)37(64)55-29(17-24-9-4-2-5-10-24)41(68)56-30(18-25-11-6-3-7-12-25)40(67)54-28(14-15-33(46)60)39(66)57-31(19-34(47)61)42(69)58-32/h2-7,9-12,26-32H,8,13-23,45H2,1H3,(H2,46,60)(H2,47,61)(H2,48,62)(H,52,65)(H,53,63)(H,54,67)(H,55,64)(H,56,68)(H,57,66)(H,58,69)(H4,49,50,51)/t26-,27+,28-,29-,30+,31+,32+/m1/s1
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n/an/an/a 2.60E+11n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(BOVINE)
BDBM50016309
PNG
(CHEMBL410025 | [Phe2Sar7]AVP (Arginine-vasopressin...)
Show SMILES CN(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1
Show InChI InChI=1S/C44H63N15O11S2/c1-59(21-36(63)53-27(13-8-16-51-44(49)50)38(65)52-20-35(48)62)43(70)32-23-72-71-22-26(45)37(64)55-29(17-24-9-4-2-5-10-24)41(68)56-30(18-25-11-6-3-7-12-25)40(67)54-28(14-15-33(46)60)39(66)57-31(19-34(47)61)42(69)58-32/h2-7,9-12,26-32H,8,13-23,45H2,1H3,(H2,46,60)(H2,47,61)(H2,48,62)(H,52,65)(H,53,63)(H,54,67)(H,55,64)(H,56,68)(H,57,66)(H,58,69)(H4,49,50,51)/t26-,27+,28-,29-,30+,31+,32+/m1/s1
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n/an/an/a 4.00E+10n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016310
PNG
(CHEMBL406303 | [Mpa1Val4Sar7]AVP (Arginine-vasopre...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H63N13O11S2/c1-24(2)37-42(67)54-31(20-33(45)59)40(65)55-32(43(68)57(3)22-36(62)51-28(10-7-16-49-44(47)48)38(63)50-21-34(46)60)23-70-69-17-15-35(61)52-29(19-26-11-13-27(58)14-12-26)39(64)53-30(41(66)56-37)18-25-8-5-4-6-9-25/h4-6,8-9,11-14,24,28-32,37,58H,7,10,15-23H2,1-3H3,(H2,45,59)(H2,46,60)(H,50,63)(H,51,62)(H,52,61)(H,53,64)(H,54,67)(H,55,65)(H,56,66)(H4,47,48,49)/t28-,29+,30-,31-,32-,37+/m0/s1
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n/an/an/a 4.20E+10n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016316
PNG
(CHEMBL413706 | [Phe2MeAla7]AVP (Arginine-vasopress...)
Show SMILES C[C@@H](N(C)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N15O11S2/c1-24(37(64)54-28(14-9-17-52-45(50)51)39(66)53-21-36(49)63)60(2)44(71)33-23-73-72-22-27(46)38(65)56-30(18-25-10-5-3-6-11-25)42(69)57-31(19-26-12-7-4-8-13-26)41(68)55-29(15-16-34(47)61)40(67)58-32(20-35(48)62)43(70)59-33/h3-8,10-13,24,27-33H,9,14-23,46H2,1-2H3,(H2,47,61)(H2,48,62)(H2,49,63)(H,53,66)(H,54,64)(H,55,68)(H,56,65)(H,57,69)(H,58,67)(H,59,70)(H4,50,51,52)/t24-,27-,28+,29-,30-,31+,32+,33+/m1/s1
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n/an/an/a 110n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016316
PNG
(CHEMBL413706 | [Phe2MeAla7]AVP (Arginine-vasopress...)
Show SMILES C[C@@H](N(C)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N15O11S2/c1-24(37(64)54-28(14-9-17-52-45(50)51)39(66)53-21-36(49)63)60(2)44(71)33-23-73-72-22-27(46)38(65)56-30(18-25-10-5-3-6-11-25)42(69)57-31(19-26-12-7-4-8-13-26)41(68)55-29(15-16-34(47)61)40(67)58-32(20-35(48)62)43(70)59-33/h3-8,10-13,24,27-33H,9,14-23,46H2,1-2H3,(H2,47,61)(H2,48,62)(H2,49,63)(H,53,66)(H,54,64)(H,55,68)(H,56,65)(H,57,69)(H,58,67)(H,59,70)(H4,50,51,52)/t24-,27-,28+,29-,30-,31+,32+,33+/m1/s1
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n/an/an/a 1.70E+11n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016310
PNG
(CHEMBL406303 | [Mpa1Val4Sar7]AVP (Arginine-vasopre...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H63N13O11S2/c1-24(2)37-42(67)54-31(20-33(45)59)40(65)55-32(43(68)57(3)22-36(62)51-28(10-7-16-49-44(47)48)38(63)50-21-34(46)60)23-70-69-17-15-35(61)52-29(19-26-11-13-27(58)14-12-26)39(64)53-30(41(66)56-37)18-25-8-5-4-6-9-25/h4-6,8-9,11-14,24,28-32,37,58H,7,10,15-23H2,1-3H3,(H2,45,59)(H2,46,60)(H,50,63)(H,51,62)(H,52,61)(H,53,64)(H,54,67)(H,55,65)(H,56,66)(H4,47,48,49)/t28-,29+,30-,31-,32-,37+/m0/s1
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n/an/an/a 27n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(BOVINE)
BDBM50016310
PNG
(CHEMBL406303 | [Mpa1Val4Sar7]AVP (Arginine-vasopre...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H63N13O11S2/c1-24(2)37-42(67)54-31(20-33(45)59)40(65)55-32(43(68)57(3)22-36(62)51-28(10-7-16-49-44(47)48)38(63)50-21-34(46)60)23-70-69-17-15-35(61)52-29(19-26-11-13-27(58)14-12-26)39(64)53-30(41(66)56-37)18-25-8-5-4-6-9-25/h4-6,8-9,11-14,24,28-32,37,58H,7,10,15-23H2,1-3H3,(H2,45,59)(H2,46,60)(H,50,63)(H,51,62)(H,52,61)(H,53,64)(H,54,67)(H,55,65)(H,56,66)(H4,47,48,49)/t28-,29+,30-,31-,32-,37+/m0/s1
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n/an/an/a 1.40n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(BOVINE)
BDBM50016316
PNG
(CHEMBL413706 | [Phe2MeAla7]AVP (Arginine-vasopress...)
Show SMILES C[C@@H](N(C)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N15O11S2/c1-24(37(64)54-28(14-9-17-52-45(50)51)39(66)53-21-36(49)63)60(2)44(71)33-23-73-72-22-27(46)38(65)56-30(18-25-10-5-3-6-11-25)42(69)57-31(19-26-12-7-4-8-13-26)41(68)55-29(15-16-34(47)61)40(67)58-32(20-35(48)62)43(70)59-33/h3-8,10-13,24,27-33H,9,14-23,46H2,1-2H3,(H2,47,61)(H2,48,62)(H2,49,63)(H,53,66)(H,54,64)(H,55,68)(H,56,65)(H,57,69)(H,58,67)(H,59,70)(H4,50,51,52)/t24-,27-,28+,29-,30-,31+,32+,33+/m1/s1
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n/an/an/a 110n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016313
PNG
(CHEMBL217517 | [Val4Sar7]AVP (Arginine-vasopressin...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H64N14O11S2/c1-23(2)36-42(68)55-31(18-33(46)60)40(66)56-32(43(69)58(3)20-35(62)52-28(10-7-15-50-44(48)49)38(64)51-19-34(47)61)22-71-70-21-27(45)37(63)53-29(17-25-11-13-26(59)14-12-25)39(65)54-30(41(67)57-36)16-24-8-5-4-6-9-24/h4-6,8-9,11-14,23,27-32,36,59H,7,10,15-22,45H2,1-3H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t27-,28+,29-,30+,31+,32+,36-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016313
PNG
(CHEMBL217517 | [Val4Sar7]AVP (Arginine-vasopressin...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H64N14O11S2/c1-23(2)36-42(68)55-31(18-33(46)60)40(66)56-32(43(69)58(3)20-35(62)52-28(10-7-15-50-44(48)49)38(64)51-19-34(47)61)22-71-70-21-27(45)37(63)53-29(17-25-11-13-26(59)14-12-25)39(65)54-30(41(67)57-36)16-24-8-5-4-6-9-24/h4-6,8-9,11-14,23,27-32,36,59H,7,10,15-22,45H2,1-3H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t27-,28+,29-,30+,31+,32+,36-/m1/s1
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n/an/an/a 1.70E+11n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(BOVINE)
BDBM50016313
PNG
(CHEMBL217517 | [Val4Sar7]AVP (Arginine-vasopressin...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H64N14O11S2/c1-23(2)36-42(68)55-31(18-33(46)60)40(66)56-32(43(69)58(3)20-35(62)52-28(10-7-15-50-44(48)49)38(64)51-19-34(47)61)22-71-70-21-27(45)37(63)53-29(17-25-11-13-26(59)14-12-25)39(65)54-30(41(67)57-36)16-24-8-5-4-6-9-24/h4-6,8-9,11-14,23,27-32,36,59H,7,10,15-22,45H2,1-3H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t27-,28+,29-,30+,31+,32+,36-/m1/s1
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n/an/an/a 9.40n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(BOVINE)
BDBM50016317
PNG
(CHEMBL2371674 | [Mpa1Val4MeAla7]AVP (Arginine-vaso...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29-,30+,31-,32-,33-,37+/m0/s1
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n/an/an/a 9.40n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM50056796
PNG
(CHEMBL435716 | DEAMINOOXYTOCIN)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H65N11O12S2/c1-5-23(4)36-42(65)49-26(12-13-32(44)56)38(61)50-29(19-33(45)57)39(62)52-30(21-68-67-16-14-35(59)48-28(40(63)53-36)18-24-8-10-25(55)11-9-24)43(66)54-15-6-7-31(54)41(64)51-27(17-22(2)3)37(60)47-20-34(46)58/h8-11,22-23,26-31,36,55H,5-7,12-21H2,1-4H3,(H2,44,56)(H2,45,57)(H2,46,58)(H,47,60)(H,48,59)(H,49,65)(H,50,61)(H,51,64)(H,52,62)(H,53,63)/t23-,26-,27-,28-,29-,30+,31-,36-/m0/s1
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n/an/an/a 1.00E+9n/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Antagonist activity in phenoxybenzamine-treated rat by Pressor assay


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016315
PNG
(CHEMBL437631 | [Val4MeAla7]AVP (Arginine-vasopress...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29+,30-,31+,32+,33+,37-/m1/s1
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n/an/an/a 4.80E+11n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from rat liver using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V1 receptor


(RAT)
BDBM50016315
PNG
(CHEMBL437631 | [Val4MeAla7]AVP (Arginine-vasopress...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29+,30-,31+,32+,33+,37-/m1/s1
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n/an/an/a 310n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(BOVINE)
BDBM50016315
PNG
(CHEMBL437631 | [Val4MeAla7]AVP (Arginine-vasopress...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29+,30-,31+,32+,33+,37-/m1/s1
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n/an/an/a 3.00E+10n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50030080
PNG
(CHEMBL411420 | [Mca1,D-Tyr(OEt)2,Sar7]AVT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)cc1
Show InChI InChI=1S/C43H68N14O12S2/c1-5-23(3)36-41(67)53-27(13-14-31(44)58)38(64)54-29(19-32(45)59)39(65)55-30(42(68)57(4)21-35(62)51-26(8-7-16-49-43(47)48)37(63)50-20-33(46)60)22-71-70-17-15-34(61)52-28(40(66)56-36)18-24-9-11-25(12-10-24)69-6-2/h9-12,23,26-30,36H,5-8,13-22H2,1-4H3,(H2,44,58)(H2,45,59)(H2,46,60)(H,50,63)(H,51,62)(H,52,61)(H,53,67)(H,54,64)(H,55,65)(H,56,66)(H4,47,48,49)/t23-,26-,27-,28-,29-,30+,36-/m0/s1
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n/an/an/a 15n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]OT binding to oxytocin receptor (OT) in guinea pig myometrium membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50030079
PNG
(CHEMBL87636 | [Mpa1,D-Phe2,Sar7]AVT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C41H64N14O11S2/c1-4-22(2)34-39(65)51-25(12-13-29(42)56)36(62)52-27(18-30(43)57)37(63)53-28(21-68-67-16-14-32(59)50-26(38(64)54-34)17-23-9-6-5-7-10-23)40(66)55(3)20-33(60)49-24(11-8-15-47-41(45)46)35(61)48-19-31(44)58/h5-7,9-10,22,24-28,34H,4,8,11-21H2,1-3H3,(H2,42,56)(H2,43,57)(H2,44,58)(H,48,61)(H,49,60)(H,50,59)(H,51,65)(H,52,62)(H,53,63)(H,54,64)(H4,45,46,47)/t22-,24-,25-,26-,27-,28+,34-/m0/s1
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n/an/an/a 8n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]OT binding to oxytocin receptor (OT) in guinea pig myometrium membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50030077
PNG
(CHEMBL330022 | [Mca1,D-Tyr(OMe)2,Sar7]AVT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N(C)CC(=O)NCC(N)=O
Show InChI InChI=1S/C41H61N11O12S2/c1-5-22(2)35-39(61)47-25(12-13-30(42)53)36(58)48-27(18-31(43)54)37(59)49-28(40(62)52-15-6-7-29(52)41(63)51(3)20-34(57)45-19-32(44)55)21-66-65-16-14-33(56)46-26(38(60)50-35)17-23-8-10-24(64-4)11-9-23/h8-11,22,25-29,35H,5-7,12-21H2,1-4H3,(H2,42,53)(H2,43,54)(H2,44,55)(H,45,57)(H,46,56)(H,47,61)(H,48,58)(H,49,59)(H,50,60)/t22-,25-,26-,27-,28+,29-,35-/m0/s1
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n/an/an/a 811n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]AVP binding to V2 receptor in bovine kidney inner medulla membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50030079
PNG
(CHEMBL87636 | [Mpa1,D-Phe2,Sar7]AVT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C41H64N14O11S2/c1-4-22(2)34-39(65)51-25(12-13-29(42)56)36(62)52-27(18-30(43)57)37(63)53-28(21-68-67-16-14-32(59)50-26(38(64)54-34)17-23-9-6-5-7-10-23)40(66)55(3)20-33(60)49-24(11-8-15-47-41(45)46)35(61)48-19-31(44)58/h5-7,9-10,22,24-28,34H,4,8,11-21H2,1-3H3,(H2,42,56)(H2,43,57)(H2,44,58)(H,48,61)(H,49,60)(H,50,59)(H,51,65)(H,52,62)(H,53,63)(H,54,64)(H4,45,46,47)/t22-,24-,25-,26-,27-,28+,34-/m0/s1
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n/an/an/a 421n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]AVP binding to V2 receptor in bovine kidney inner medulla membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50030077
PNG
(CHEMBL330022 | [Mca1,D-Tyr(OMe)2,Sar7]AVT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N(C)CC(=O)NCC(N)=O
Show InChI InChI=1S/C41H61N11O12S2/c1-5-22(2)35-39(61)47-25(12-13-30(42)53)36(58)48-27(18-31(43)54)37(59)49-28(40(62)52-15-6-7-29(52)41(63)51(3)20-34(57)45-19-32(44)55)21-66-65-16-14-33(56)46-26(38(60)50-35)17-23-8-10-24(64-4)11-9-23/h8-11,22,25-29,35H,5-7,12-21H2,1-4H3,(H2,42,53)(H2,43,54)(H2,44,55)(H,45,57)(H,46,56)(H,47,61)(H,48,58)(H,49,59)(H,50,60)/t22-,25-,26-,27-,28+,29-,35-/m0/s1
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n/an/an/a 18n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]OT binding to oxytocin receptor (OT) in guinea pig myometrium membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50030083
PNG
(CHEMBL414582 | [Mca1,D-Phe2,Sar7]AVT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C46H72N14O11S2/c1-4-26(2)38-43(70)56-29(15-16-33(47)61)40(67)57-31(21-34(48)62)41(68)58-32(44(71)60(3)24-37(65)54-28(14-11-19-52-45(50)51)39(66)53-23-35(49)63)25-72-73-46(17-9-6-10-18-46)22-36(64)55-30(42(69)59-38)20-27-12-7-5-8-13-27/h5,7-8,12-13,26,28-32,38H,4,6,9-11,14-25H2,1-3H3,(H2,47,61)(H2,48,62)(H2,49,63)(H,53,66)(H,54,65)(H,55,64)(H,56,70)(H,57,67)(H,58,68)(H,59,69)(H4,50,51,52)/t26-,28-,29-,30-,31-,32+,38-/m0/s1
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n/an/an/a 311n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]AVP binding to V2 receptor in bovine kidney inner medulla membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50030080
PNG
(CHEMBL411420 | [Mca1,D-Tyr(OEt)2,Sar7]AVT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)cc1
Show InChI InChI=1S/C43H68N14O12S2/c1-5-23(3)36-41(67)53-27(13-14-31(44)58)38(64)54-29(19-32(45)59)39(65)55-30(42(68)57(4)21-35(62)51-26(8-7-16-49-43(47)48)37(63)50-20-33(46)60)22-71-70-17-15-34(61)52-28(40(66)56-36)18-24-9-11-25(12-10-24)69-6-2/h9-12,23,26-30,36H,5-8,13-22H2,1-4H3,(H2,44,58)(H2,45,59)(H2,46,60)(H,50,63)(H,51,62)(H,52,61)(H,53,67)(H,54,64)(H,55,65)(H,56,66)(H4,47,48,49)/t23-,26-,27-,28-,29-,30+,36-/m0/s1
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n/an/an/a 130n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]AVP binding to V2 receptor in bovine kidney inner medulla membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50016315
PNG
(CHEMBL437631 | [Val4MeAla7]AVP (Arginine-vasopress...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29+,30-,31+,32+,33+,37-/m1/s1
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n/an/an/a 33n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50016317
PNG
(CHEMBL2371674 | [Mpa1Val4MeAla7]AVP (Arginine-vaso...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N13O11S2/c1-24(2)37-43(68)55-32(21-34(46)60)41(66)56-33(44(69)58(4)25(3)38(63)53-29(11-8-17-50-45(48)49)39(64)51-22-35(47)61)23-71-70-18-16-36(62)52-30(20-27-12-14-28(59)15-13-27)40(65)54-31(42(67)57-37)19-26-9-6-5-7-10-26/h5-7,9-10,12-15,24-25,29-33,37,59H,8,11,16-23H2,1-4H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t25-,29-,30+,31-,32-,33-,37+/m0/s1
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n/an/an/a 8.50E+9n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50016313
PNG
(CHEMBL217517 | [Val4Sar7]AVP (Arginine-vasopressin...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H64N14O11S2/c1-23(2)36-42(68)55-31(18-33(46)60)40(66)56-32(43(69)58(3)20-35(62)52-28(10-7-15-50-44(48)49)38(64)51-19-34(47)61)22-71-70-21-27(45)37(63)53-29(17-25-11-13-26(59)14-12-25)39(65)54-30(41(67)57-36)16-24-8-5-4-6-9-24/h4-6,8-9,11-14,23,27-32,36,59H,7,10,15-22,45H2,1-3H3,(H2,46,60)(H2,47,61)(H,51,64)(H,52,62)(H,53,63)(H,54,65)(H,55,68)(H,56,66)(H,57,67)(H4,48,49,50)/t27-,28+,29-,30+,31+,32+,36-/m1/s1
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n/an/an/a 8.50E+9n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50016309
PNG
(CHEMBL410025 | [Phe2Sar7]AVP (Arginine-vasopressin...)
Show SMILES CN(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1
Show InChI InChI=1S/C44H63N15O11S2/c1-59(21-36(63)53-27(13-8-16-51-44(49)50)38(65)52-20-35(48)62)43(70)32-23-72-71-22-26(45)37(64)55-29(17-24-9-4-2-5-10-24)41(68)56-30(18-25-11-6-3-7-12-25)40(67)54-28(14-15-33(46)60)39(66)57-31(19-34(47)61)42(69)58-32/h2-7,9-12,26-32H,8,13-23,45H2,1H3,(H2,46,60)(H2,47,61)(H2,48,62)(H,52,65)(H,53,63)(H,54,67)(H,55,64)(H,56,68)(H,57,66)(H,58,69)(H4,49,50,51)/t26-,27+,28-,29-,30+,31+,32+/m1/s1
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n/an/an/a 44n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50016316
PNG
(CHEMBL413706 | [Phe2MeAla7]AVP (Arginine-vasopress...)
Show SMILES C[C@@H](N(C)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C45H65N15O11S2/c1-24(37(64)54-28(14-9-17-52-45(50)51)39(66)53-21-36(49)63)60(2)44(71)33-23-73-72-22-27(46)38(65)56-30(18-25-10-5-3-6-11-25)42(69)57-31(19-26-12-7-4-8-13-26)41(68)55-29(15-16-34(47)61)40(67)58-32(20-35(48)62)43(70)59-33/h3-8,10-13,24,27-33H,9,14-23,46H2,1-2H3,(H2,47,61)(H2,48,62)(H2,49,63)(H,53,66)(H,54,64)(H,55,68)(H,56,65)(H,57,69)(H,58,67)(H,59,70)(H4,50,51,52)/t24-,27-,28+,29-,30-,31+,32+,33+/m1/s1
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n/an/an/a 1.00E+11n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
AVPR2


(BOVINE)
BDBM50016310
PNG
(CHEMBL406303 | [Mpa1Val4Sar7]AVP (Arginine-vasopre...)
Show SMILES CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H63N13O11S2/c1-24(2)37-42(67)54-31(20-33(45)59)40(65)55-32(43(68)57(3)22-36(62)51-28(10-7-16-49-44(47)48)38(63)50-21-34(46)60)23-70-69-17-15-35(61)52-29(19-26-11-13-27(58)14-12-26)39(64)53-30(41(66)56-37)18-25-8-5-4-6-9-25/h4-6,8-9,11-14,24,28-32,37,58H,7,10,15-23H2,1-3H3,(H2,45,59)(H2,46,60)(H,50,63)(H,51,62)(H,52,61)(H,53,64)(H,54,67)(H,55,65)(H,56,66)(H4,47,48,49)/t28-,29+,30-,31-,32-,37+/m0/s1
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n/an/an/a 1.30E+9n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]-AVP as a radioligand


J Med Chem 29: 96-9 (1986)


Article DOI: 10.1021/jm00151a016
BindingDB Entry DOI: 10.7270/Q2P849V1
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50030083
PNG
(CHEMBL414582 | [Mca1,D-Phe2,Sar7]AVT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O
Show InChI InChI=1S/C46H72N14O11S2/c1-4-26(2)38-43(70)56-29(15-16-33(47)61)40(67)57-31(21-34(48)62)41(68)58-32(44(71)60(3)24-37(65)54-28(14-11-19-52-45(50)51)39(66)53-23-35(49)63)25-72-73-46(17-9-6-10-18-46)22-36(64)55-30(42(69)59-38)20-27-12-7-5-8-13-27/h5,7-8,12-13,26,28-32,38H,4,6,9-11,14-25H2,1-3H3,(H2,47,61)(H2,48,62)(H2,49,63)(H,53,66)(H,54,65)(H,55,64)(H,56,70)(H,57,67)(H,58,68)(H,59,69)(H4,50,51,52)/t26-,28-,29-,30-,31-,32+,38-/m0/s1
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n/an/an/a 8n/an/an/an/an/a



Max-Planck-Institut f£r Biophysik

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]OT binding to oxytocin receptor (OT) in guinea pig myometrium membrane


J Med Chem 37: 255-9 (1994)


Article DOI: 10.1021/jm00028a008
BindingDB Entry DOI: 10.7270/Q2H995TM
More data for this
Ligand-Target Pair