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PubMed code 16722659

Compile data set for download or QSAR
Found 33 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370722
PNG
(CHEMBL1791358)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58N8O12S/c1-4-25(2)38(51-42(59)37(24-65)46-26(3)53)43(60)49-35(22-28-10-16-31(54)17-11-28)40(57)47-33(7-5-6-20-45)39(56)48-34(21-27-8-14-30(15-9-27)52(63)64)41(58)50-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,65H,4-7,20-24,45H2,1-3H3,(H,46,53)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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PubMed
210n/an/an/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC in presence of ATP


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187738
PNG
(Ac-Cys-Ile-cyclo[Phe-Lys]-Tyr-Tyr | CHEMBL428631)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](CS)NC(C)=O)C(=O)N[C@H]1Cc2ccc(NC(=O)CCCCCCC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
Show InChI InChI=1S/C52H70N8O12S/c1-4-31(2)46(60-50(69)43(30-73)54-32(3)61)51(70)58-41-27-33-14-20-36(21-15-33)55-45(65)13-8-6-5-7-12-44(64)53-26-10-9-11-39(56-48(41)67)47(66)57-40(28-34-16-22-37(62)23-17-34)49(68)59-42(52(71)72)29-35-18-24-38(63)25-19-35/h14-25,31,39-43,46,62-63,73H,4-13,26-30H2,1-3H3,(H,53,64)(H,54,61)(H,55,65)(H,56,67)(H,57,66)(H,58,70)(H,59,68)(H,60,69)(H,71,72)/t31-,39-,40-,41-,42-,43+,46-/m0/s1
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n/an/a 280n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370722
PNG
(CHEMBL1791358)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58N8O12S/c1-4-25(2)38(51-42(59)37(24-65)46-26(3)53)43(60)49-35(22-28-10-16-31(54)17-11-28)40(57)47-33(7-5-6-20-45)39(56)48-34(21-27-8-14-30(15-9-27)52(63)64)41(58)50-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,65H,4-7,20-24,45H2,1-3H3,(H,46,53)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 530n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370720
PNG
(CHEMBL1791362)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58IN7O10S/c1-4-25(2)38(52-42(59)37(24-63)47-26(3)53)43(60)50-35(22-28-10-16-31(54)17-11-28)40(57)48-33(7-5-6-20-46)39(56)49-34(21-27-8-14-30(45)15-9-27)41(58)51-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,63H,4-7,20-24,46H2,1-3H3,(H,47,53)(H,48,57)(H,49,56)(H,50,60)(H,51,58)(H,52,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 780n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370725
PNG
(CHEMBL1791373)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C53H67N9O13S/c1-4-31(2)46(61-51(70)45(30-76)55-32(3)63)52(71)59-43(28-36-17-23-39(65)24-18-36)48(67)56-40(12-8-9-25-54)47(66)57-41(26-34-13-19-37(20-14-34)62(74)75)49(68)58-42(27-35-15-21-38(64)22-16-35)50(69)60-44(53(72)73)29-33-10-6-5-7-11-33/h5-7,10-11,13-24,31,40-46,64-65,76H,4,8-9,12,25-30,54H2,1-3H3,(H,55,63)(H,56,67)(H,57,66)(H,58,68)(H,59,71)(H,60,69)(H,61,70)(H,72,73)/t31-,40-,41-,42-,43-,44-,45-,46-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370729
PNG
(CHEMBL1791361)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H57N9O13S/c1-4-25(2)38(51-42(59)37(24-67)46-26(3)54)43(60)49-35(22-28-10-16-31(17-11-28)53(65)66)40(57)47-33(7-5-6-20-45)39(56)48-34(21-27-8-14-30(15-9-27)52(63)64)41(58)50-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,55,67H,4-7,20-24,45H2,1-3H3,(H,46,54)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370735
PNG
(CHEMBL1791374)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58N8O12S/c1-4-25(2)38(51-42(59)37(24-65)46-26(3)53)43(60)49-35(21-27-8-14-30(15-9-27)52(63)64)40(57)47-33(7-5-6-20-45)39(56)48-34(22-28-10-16-31(54)17-11-28)41(58)50-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,65H,4-7,20-24,45H2,1-3H3,(H,46,53)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187732
PNG
(Ac-Cys-Ile-cyclo[Phe-Lys]-Tyr-Tyr | CHEMBL209045)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@H]1Cc2ccc(NC(=O)CCC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
Show InChI InChI=1S/C48H62N8O12S/c1-4-27(2)42(56-46(65)39(26-69)50-28(3)57)47(66)54-37-23-29-8-14-32(15-9-29)51-41(61)21-20-40(60)49-22-6-5-7-35(52-44(37)63)43(62)53-36(24-30-10-16-33(58)17-11-30)45(64)55-38(48(67)68)25-31-12-18-34(59)19-13-31/h8-19,27,35-39,42,58-59,69H,4-7,20-26H2,1-3H3,(H,49,60)(H,50,57)(H,51,61)(H,52,63)(H,53,62)(H,54,66)(H,55,64)(H,56,65)(H,67,68)/t27-,35-,36-,37-,38-,39-,42-/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370724
PNG
(CHEMBL1791376)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)N=[N+]=[N-])C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58N10O10S/c1-4-25(2)38(52-42(61)37(24-65)47-26(3)55)43(62)50-35(22-28-10-16-31(56)17-11-28)40(59)48-33(7-5-6-20-45)39(58)49-34(21-27-8-14-30(15-9-27)53-54-46)41(60)51-36(44(63)64)23-29-12-18-32(57)19-13-29/h8-19,25,33-38,56-57,65H,4-7,20-24,45H2,1-3H3,(H,47,55)(H,48,59)(H,49,58)(H,50,62)(H,51,60)(H,52,61)(H,63,64)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370730
PNG
(CHEMBL1791372)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C44H57N9O13S/c1-4-25(2)38(51-42(59)37(24-67)46-26(3)54)43(60)49-35(21-27-8-14-30(15-9-27)52(63)64)40(57)47-33(7-5-6-20-45)39(56)48-34(22-29-12-18-32(55)19-13-29)41(58)50-36(44(61)62)23-28-10-16-31(17-11-28)53(65)66/h8-19,25,33-38,55,67H,4-7,20-24,45H2,1-3H3,(H,46,54)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 3.40E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370728
PNG
(CHEMBL1791375)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C44H57N9O13S/c1-4-25(2)38(51-42(59)37(24-67)46-26(3)54)43(60)49-35(22-29-12-18-32(55)19-13-29)40(57)47-33(7-5-6-20-45)39(56)48-34(21-27-8-14-30(15-9-27)52(63)64)41(58)50-36(44(61)62)23-28-10-16-31(17-11-28)53(65)66/h8-19,25,33-38,55,67H,4-7,20-24,45H2,1-3H3,(H,46,54)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 5.60E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370731
PNG
(CHEMBL1791368)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)C#N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C45H58N8O10S/c1-4-26(2)39(53-43(60)38(25-64)48-27(3)54)44(61)51-36(22-29-12-16-32(55)17-13-29)41(58)49-34(7-5-6-20-46)40(57)50-35(21-28-8-10-31(24-47)11-9-28)42(59)52-37(45(62)63)23-30-14-18-33(56)19-15-30/h8-19,26,34-39,55-56,64H,4-7,20-23,25,46H2,1-3H3,(H,48,54)(H,49,58)(H,50,57)(H,51,61)(H,52,59)(H,53,60)(H,62,63)/t26-,34-,35-,36-,37-,38-,39-/m0/s1
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n/an/a 6.00E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187729
PNG
(CHEMBL429525 | Cyclo[Ac-Cys-Ile-Tyr-Lys-Tyr-Tyr])
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O
Show InChI InChI=1S/C42H55N7O9S/c1-3-24(2)36-42(58)47-34(22-27-11-17-30(52)18-12-27)38(54)44-31(6-4-5-19-43)37(53)45-32(20-25-7-13-28(50)14-8-25)39(55)46-33(21-26-9-15-29(51)16-10-26)40(56)48-35(23-59)41(57)49-36/h7-18,24,31-36,50-52,59H,3-6,19-23,43H2,1-2H3,(H,44,54)(H,45,53)(H,46,55)(H,47,58)(H,48,56)(H,49,57)/t24-,31-,32-,33-,34-,35-,36-/m0/s1
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n/an/a 6.40E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370737
PNG
(CHEMBL1791356)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58ClN7O10S/c1-4-25(2)38(52-42(59)37(24-63)47-26(3)53)43(60)50-35(22-28-10-16-31(54)17-11-28)40(57)48-33(7-5-6-20-46)39(56)49-34(21-27-8-14-30(45)15-9-27)41(58)51-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,63H,4-7,20-24,46H2,1-3H3,(H,47,53)(H,48,57)(H,49,56)(H,50,60)(H,51,58)(H,52,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 7.30E+3n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370718
PNG
(CHEMBL1791371)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C44H58N8O12S/c1-4-25(2)38(51-42(59)37(24-65)46-26(3)53)43(60)49-35(22-29-12-18-32(55)19-13-29)40(57)47-33(7-5-6-20-45)39(56)48-34(21-28-10-16-31(54)17-11-28)41(58)50-36(44(61)62)23-27-8-14-30(15-9-27)52(63)64/h8-19,25,33-38,54-55,65H,4-7,20-24,45H2,1-3H3,(H,46,53)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 1.08E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187720
PNG
(CHEMBL380288 | Cyclo[Ac-Cys-Ile-Tyr-Lys-Tyr-Phe])
Show SMILES CC[C@H](C)C1NC(=O)[C@H](CS)NC(=O)CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(O)cc3)NC1=O)C(O)=O)cc2
Show InChI InChI=1S/C46H60N8O11S/c1-3-26(2)40-45(63)52-35(23-29-11-17-32(56)18-12-29)42(60)50-33(6-4-5-21-47)41(59)51-34(22-28-9-15-31(55)16-10-28)43(61)53-36(46(64)65)24-27-7-13-30(14-8-27)48-38(57)19-20-39(58)49-37(25-66)44(62)54-40/h7-18,26,33-37,40,55-56,66H,3-6,19-25,47H2,1-2H3,(H,48,57)(H,49,58)(H,50,60)(H,51,59)(H,52,63)(H,53,61)(H,54,62)(H,64,65)/t26-,33-,34-,35-,36-,37-,40?/m0/s1
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n/an/a 1.60E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370727
PNG
(CHEMBL1791369)
Show SMILES CC[C@@H](C)[C@@H]1NC(=O)[C@@H](CS)NC(=O)CCC(=O)Nc2ccc(cc2)[C@H](NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C45H58N8O11S/c1-3-25(2)38-43(61)53-39(28-11-13-29(14-12-28)47-36(56)19-20-37(57)48-35(24-65)42(60)52-38)44(62)49-32(6-4-5-21-46)40(58)50-33(22-26-7-15-30(54)16-8-26)41(59)51-34(45(63)64)23-27-9-17-31(55)18-10-27/h7-18,25,32-35,38-39,54-55,65H,3-6,19-24,46H2,1-2H3,(H,47,56)(H,48,57)(H,49,62)(H,50,58)(H,51,59)(H,52,60)(H,53,61)(H,63,64)/t25-,32+,33+,34+,35-,38+,39+/m1/s1
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n/an/a 1.70E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370721
PNG
(CHEMBL1791360)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H58FN7O10S/c1-4-25(2)38(52-42(59)37(24-63)47-26(3)53)43(60)50-35(22-28-10-16-31(54)17-11-28)40(57)48-33(7-5-6-20-46)39(56)49-34(21-27-8-14-30(45)15-9-27)41(58)51-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,63H,4-7,20-24,46H2,1-3H3,(H,47,53)(H,48,57)(H,49,56)(H,50,60)(H,51,58)(H,52,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 2.60E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187743
PNG
(Ac-Cys-Ile-cyclo[Phe-Lys-Tyr-Tyr] | CHEMBL267213)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@H]1Cc2ccc(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CCCCN)NC1=O)cc2
Show InChI InChI=1S/C44H58N8O9S/c1-4-25(2)38(52-43(60)37(24-62)46-26(3)53)44(61)51-36-21-27-8-14-30(15-9-27)47-40(57)34(22-28-10-16-31(54)17-11-28)50-42(59)35(23-29-12-18-32(55)19-13-29)49-39(56)33(48-41(36)58)7-5-6-20-45/h8-19,25,33-38,54-55,62H,4-7,20-24,45H2,1-3H3,(H,46,53)(H,47,57)(H,48,58)(H,49,56)(H,50,59)(H,51,61)(H,52,60)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 3.36E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370719
PNG
(CHEMBL1791364)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCCNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O
Show InChI InChI=1S/C44H57N7O10S/c1-4-25(2)38(51-43(60)37(24-62)46-26(3)52)44(61)50-36(23-29-12-18-32(55)19-13-29)41(58)47-33-7-5-6-20-45-39(56)34(21-27-8-14-30(53)15-9-27)48-42(59)35(49-40(33)57)22-28-10-16-31(54)17-11-28/h8-19,25,33-38,53-55,62H,4-7,20-24H2,1-3H3,(H,45,56)(H,46,52)(H,47,58)(H,48,59)(H,49,57)(H,50,61)(H,51,60)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 5.45E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370732
PNG
(CHEMBL1791365)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C46H59N7O12S/c1-3-26(2)40-45(63)51-35(23-28-9-15-31(55)16-10-28)42(60)49-33(6-4-5-21-47-38(57)19-20-39(58)48-37(25-66)44(62)53-40)41(59)50-34(22-27-7-13-30(54)14-8-27)43(61)52-36(46(64)65)24-29-11-17-32(56)18-12-29/h7-18,26,33-37,40,54-56,66H,3-6,19-25H2,1-2H3,(H,47,57)(H,48,58)(H,49,60)(H,50,59)(H,51,63)(H,52,61)(H,53,62)(H,64,65)/t26-,33-,34-,35-,36-,37-,40-/m0/s1
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n/an/a 7.50E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370736
PNG
(CHEMBL1791367)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H60N8O10S/c1-4-25(2)38(52-42(59)37(24-63)47-26(3)53)43(60)50-35(22-28-10-16-31(54)17-11-28)40(57)48-33(7-5-6-20-45)39(56)49-34(21-27-8-14-30(46)15-9-27)41(58)51-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,63H,4-7,20-24,45-46H2,1-3H3,(H,47,53)(H,48,57)(H,49,56)(H,50,60)(H,51,58)(H,52,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 9.30E+4n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370739
PNG
(CHEMBL1791378)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C46H58N8O13S/c1-3-26(2)40-45(63)51-35(23-28-9-15-31(55)16-10-28)42(60)49-33(6-4-5-21-47-38(57)19-20-39(58)48-37(25-68)44(62)53-40)41(59)50-34(22-27-7-13-30(14-8-27)54(66)67)43(61)52-36(46(64)65)24-29-11-17-32(56)18-12-29/h7-18,26,33-37,40,55-56,68H,3-6,19-25H2,1-2H3,(H,47,57)(H,48,58)(H,49,60)(H,50,59)(H,51,63)(H,52,61)(H,53,62)(H,64,65)/t26-,33-,34-,35-,36-,37-,40-/m0/s1
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n/an/a 1.34E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370741
PNG
(CHEMBL1791366)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCCNC(=O)CCC(=O)Nc2ccc(C[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
Show InChI InChI=1S/C48H62N8O12S/c1-4-27(2)42(56-46(65)39(26-69)50-28(3)57)47(66)54-37(24-30-10-16-33(58)17-11-30)44(63)52-35-7-5-6-22-49-40(60)20-21-41(61)51-32-14-8-29(9-15-32)23-36(53-43(35)62)45(64)55-38(48(67)68)25-31-12-18-34(59)19-13-31/h8-19,27,35-39,42,58-59,69H,4-7,20-26H2,1-3H3,(H,49,60)(H,50,57)(H,51,61)(H,52,63)(H,53,62)(H,54,66)(H,55,64)(H,56,65)(H,67,68)/t27-,35-,36-,37-,38-,39-,42-/m0/s1
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n/an/a>4.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187724
PNG
(CHEMBL378962 | Cyclo[Ac-Cys-Ile-Tyr-Lys-Phe]-Tyr)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(O)cc3)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
Show InChI InChI=1S/C46H60N8O11S/c1-3-26(2)40-45(63)52-35(23-28-9-15-31(55)16-10-28)42(60)50-33(6-4-5-21-47)41(59)51-34(43(61)53-36(46(64)65)24-29-11-17-32(56)18-12-29)22-27-7-13-30(14-8-27)48-38(57)19-20-39(58)49-37(25-66)44(62)54-40/h7-18,26,33-37,40,55-56,66H,3-6,19-25,47H2,1-2H3,(H,48,57)(H,49,58)(H,50,60)(H,51,59)(H,52,63)(H,53,61)(H,54,62)(H,64,65)/t26-,33-,34-,35-,36-,37-,40-/m0/s1
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n/an/a>4.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370738
PNG
(CHEMBL1791370)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H59N7O11S/c1-4-25(2)38(51-42(59)37(24-63)46-26(3)52)43(60)49-35(22-28-10-16-31(54)17-11-28)40(57)47-33(7-5-6-20-45)39(56)48-34(21-27-8-14-30(53)15-9-27)41(58)50-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,53-55,63H,4-7,20-24,45H2,1-3H3,(H,46,52)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 4.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370726
PNG
(CHEMBL1791357)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H59N7O10S/c1-4-26(2)38(51-42(58)37(25-62)46-27(3)52)43(59)49-35(23-29-13-17-31(53)18-14-29)40(56)47-33(12-8-9-21-45)39(55)48-34(22-28-10-6-5-7-11-28)41(57)50-36(44(60)61)24-30-15-19-32(54)20-16-30/h5-7,10-11,13-20,26,33-38,53-54,62H,4,8-9,12,21-25,45H2,1-3H3,(H,46,52)(H,47,56)(H,48,55)(H,49,59)(H,50,57)(H,51,58)(H,60,61)/t26-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a>7.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370734
PNG
(CHEMBL1791355)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(N)cc1)C(O)=O
Show InChI InChI=1S/C44H60N8O10S/c1-4-25(2)38(52-42(59)37(24-63)47-26(3)53)43(60)50-35(22-29-12-18-32(55)19-13-29)40(57)48-33(7-5-6-20-45)39(56)49-34(21-28-10-16-31(54)17-11-28)41(58)51-36(44(61)62)23-27-8-14-30(46)15-9-27/h8-19,25,33-38,54-55,63H,4-7,20-24,45-46H2,1-3H3,(H,47,53)(H,48,57)(H,49,56)(H,50,60)(H,51,58)(H,52,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a>7.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187744
PNG
(Ac-Cys-Tyr-Lys-Tyr(4-PO3H2)-Tyr | CHEMBL378042)
Show SMILES CC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)P(O)(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C38H49N6O12PS/c1-22(45)40-33(21-58)37(51)43-30(18-23-5-11-26(46)12-6-23)35(49)41-29(4-2-3-17-39)34(48)42-31(19-25-9-15-28(16-10-25)57(54,55)56)36(50)44-32(38(52)53)20-24-7-13-27(47)14-8-24/h5-16,29-33,46-47,58H,2-4,17-21,39H2,1H3,(H,40,45)(H,41,49)(H,42,48)(H,43,51)(H,44,50)(H,52,53)(H2,54,55,56)/t29-,30-,31-,32-,33-/m0/s1
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n/an/a>7.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370723
PNG
(CHEMBL1791363)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(NS(C)(=O)=O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C45H62N8O12S2/c1-5-26(2)39(52-43(60)38(25-66)47-27(3)54)44(61)50-36(23-29-11-17-32(55)18-12-29)41(58)48-34(8-6-7-21-46)40(57)49-35(22-28-9-15-31(16-10-28)53-67(4,64)65)42(59)51-37(45(62)63)24-30-13-19-33(56)20-14-30/h9-20,26,34-39,53,55-56,66H,5-8,21-25,46H2,1-4H3,(H,47,54)(H,48,58)(H,49,57)(H,50,61)(H,51,59)(H,52,60)(H,62,63)/t26-,34-,35-,36-,37-,38-,39-/m0/s1
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n/an/a>7.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370733
PNG
(CHEMBL1791377)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)N=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C45H62N10O10S/c1-4-25(2)38(55-42(62)37(24-66)49-26(3)56)43(63)53-35(22-28-10-16-31(57)17-11-28)40(60)51-33(7-5-6-20-46)39(59)52-34(21-27-8-14-30(15-9-27)50-45(47)48)41(61)54-36(44(64)65)23-29-12-18-32(58)19-13-29/h8-19,25,33-38,57-58,66H,4-7,20-24,46H2,1-3H3,(H,49,56)(H,51,60)(H,52,59)(H,53,63)(H,54,61)(H,55,62)(H,64,65)(H4,47,48,50)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a>7.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50187725
PNG
(Ac-Cys-Ile-Tyr-Lys-Tyr(4-PO3H2)-Tyr | CHEMBL380085)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)P(O)(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H60N7O13PS/c1-4-25(2)38(51-42(58)37(24-66)46-26(3)52)43(59)49-35(21-27-8-14-30(53)15-9-27)40(56)47-33(7-5-6-20-45)39(55)48-34(22-29-12-18-32(19-13-29)65(62,63)64)41(57)50-36(44(60)61)23-28-10-16-31(54)17-11-28/h8-19,25,33-38,53-54,66H,4-7,20-24,45H2,1-3H3,(H,46,52)(H,47,56)(H,48,55)(H,49,59)(H,50,57)(H,51,58)(H,60,61)(H2,62,63,64)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a>7.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50370740
PNG
(CHEMBL1791359)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C44H60N8O10S/c1-4-25(2)38(52-42(59)37(24-63)47-26(3)53)43(60)50-35(21-27-8-14-30(46)15-9-27)40(57)48-33(7-5-6-20-45)39(56)49-34(22-28-10-16-31(54)17-11-28)41(58)51-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,54-55,63H,4-7,20-24,45-46H2,1-3H3,(H,47,53)(H,48,57)(H,49,56)(H,50,60)(H,51,58)(H,52,59)(H,61,62)/t25-,33-,34-,35-,36-,37-,38-/m0/s1
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n/an/a 7.60E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of SRC using polyE4Y as substrate


J Med Chem 49: 3395-401 (2006)


Article DOI: 10.1021/jm060334k
BindingDB Entry DOI: 10.7270/Q22F7P7S
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%