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PubMed code 7510340

Compile data set for download or QSAR
Found 47 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
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4007
PNG
(1 H-indole-3-alkanamide deriv. 10p | 2,2 -Dithiobi...)
Show SMILES CC(=O)NC(Cc1c(SSc2[nH]c3ccccc3c2CC(NC(C)=O)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C40H40N6O4S2/c1-25(47)43-35(37(49)41-23-27-13-5-3-6-14-27)21-31-29-17-9-11-19-33(29)45-39(31)51-52-40-32(30-18-10-12-20-34(30)46-40)22-36(44-26(2)48)38(50)42-24-28-15-7-4-8-16-28/h3-20,35-36,45-46H,21-24H2,1-2H3,(H,41,49)(H,42,50)(H,43,47)(H,44,48)
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n/an/a 500n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4008
PNG
(1 H-indole-3-alkanamide deriv. 10q | 2,2-Dithiobis...)
Show SMILES FC(F)(F)C(=O)NC(Cc1c(SSc2[nH]c3ccccc3c2CC(NC(=O)C(F)(F)F)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C40H34F6N6O4S2/c41-39(42,43)37(55)51-31(33(53)47-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-29(25)49-35(27)57-58-36-28(26-16-8-10-18-30(26)50-36)20-32(52-38(56)40(44,45)46)34(54)48-22-24-13-5-2-6-14-24/h1-18,31-32,49-50H,19-22H2,(H,47,53)(H,48,54)(H,51,55)(H,52,56)
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n/an/a 700n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3997
PNG
(1 H-indole-3-alkanamide deriv. 10f | N-methyl-3-[2...)
Show SMILES CNC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NC)[nH]c2ccccc12
Show InChI InChI=1S/C24H26N4O2S2/c1-25-21(29)13-11-17-15-7-3-5-9-19(15)27-23(17)31-32-24-18(12-14-22(30)26-2)16-8-4-6-10-20(16)28-24/h3-10,27-28H,11-14H2,1-2H3,(H,25,29)(H,26,30)
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n/an/a 750n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4001
PNG
(1 H-indole-3-alkanamide deriv. 10j | N-benzyl-3-[2...)
Show SMILES O=C(CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NCc2ccccc2)[nH]c2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C36H34N4O2S2/c41-33(37-23-25-11-3-1-4-12-25)21-19-29-27-15-7-9-17-31(27)39-35(29)43-44-36-30(28-16-8-10-18-32(28)40-36)20-22-34(42)38-24-26-13-5-2-6-14-26/h1-18,39-40H,19-24H2,(H,37,41)(H,38,42)
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n/an/a 850n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3999
PNG
(1 H-indole-3-alkanamide deriv. 10h | 3-[2-({3-[2-(...)
Show SMILES CN(C)C(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)N(C)C)[nH]c2ccccc12
Show InChI InChI=1S/C26H30N4O2S2/c1-29(2)23(31)15-13-19-17-9-5-7-11-21(17)27-25(19)33-34-26-20(14-16-24(32)30(3)4)18-10-6-8-12-22(18)28-26/h5-12,27-28H,13-16H2,1-4H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4012
PNG
(1 H-indole-3-alkanamide deriv. 10u | N-benzyl-4-[2...)
Show SMILES O=C(CCCc1c(SSc2[nH]c3ccccc3c2CCCC(=O)NCc2ccccc2)[nH]c2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C38H38N4O2S2/c43-35(39-25-27-13-3-1-4-14-27)23-11-19-31-29-17-7-9-21-33(29)41-37(31)45-46-38-32(30-18-8-10-22-34(30)42-38)20-12-24-36(44)40-26-28-15-5-2-6-16-28/h1-10,13-18,21-22,41-42H,11-12,19-20,23-26H2,(H,39,43)(H,40,44)
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n/an/a 1.30E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3996
PNG
(1 H-indole-3-alkanamide deriv. 10e | 2,2 -Dithiobi...)
Show SMILES NC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(N)=O)[nH]c2ccccc12
Show InChI InChI=1S/C22H22N4O2S2/c23-19(27)11-9-15-13-5-1-3-7-17(13)25-21(15)29-30-22-16(10-12-20(24)28)14-6-2-4-8-18(14)26-22/h1-8,25-26H,9-12H2,(H2,23,27)(H2,24,28)
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n/an/a 1.50E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3351
PNG
(2-amino-3-[2-({3-[2-amino-2-(benzylcarbamoyl)ethyl...)
Show SMILES NC(Cc1c(SSc2[nH]c3ccccc3c2CC(N)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C36H36N6O2S2/c37-29(33(43)39-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-31(25)41-35(27)45-46-36-28(26-16-8-10-18-32(26)42-36)20-30(38)34(44)40-22-24-13-5-2-6-14-24/h1-18,29-30,41-42H,19-22,37-38H2,(H,39,43)(H,40,44)
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n/an/a 1.50E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4003
PNG
(1 H-indole-3-alkanamide deriv. 10l | 2,2 -Dithiobi...)
Show SMILES OC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(cc3)C(O)=O)[nH]c3ccccc23)cc1
Show InChI InChI=1S/C38H34N4O6S2/c43-33(39-21-23-9-13-25(14-10-23)37(45)46)19-17-29-27-5-1-3-7-31(27)41-35(29)49-50-36-30(28-6-2-4-8-32(28)42-36)18-20-34(44)40-22-24-11-15-26(16-12-24)38(47)48/h1-16,41-42H,17-22H2,(H,39,43)(H,40,44)(H,45,46)(H,47,48)
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n/an/a 1.50E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4002
PNG
(1 H-indole-3-alkanamide deriv. 10k | 2,2 -dithiobi...)
Show SMILES COC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(cc3)C(=O)OC)[nH]c3ccccc23)cc1
Show InChI InChI=1S/C40H38N4O6S2/c1-49-39(47)27-15-11-25(12-16-27)23-41-35(45)21-19-31-29-7-3-5-9-33(29)43-37(31)51-52-38-32(30-8-4-6-10-34(30)44-38)20-22-36(46)42-24-26-13-17-28(18-14-26)40(48)50-2/h3-18,43-44H,19-24H2,1-2H3,(H,41,45)(H,42,46)
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n/an/a 1.80E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4014
PNG
(1 H-indole-3-alkanamide deriv. 11e | 2,3-Dihydro-2...)
Show SMILES NC(=O)CCC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C11H12N2OS/c12-10(14)6-5-8-7-3-1-2-4-9(7)13-11(8)15/h1-4,8H,5-6H2,(H2,12,14)(H,13,15)
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n/an/a 2.00E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3991
PNG
(1 H-indole-3-alkanamide deriv. 10b | 2-(2-{[3-(cya...)
Show SMILES N#CCc1c(SSc2[nH]c3ccccc3c2CC#N)[nH]c2ccccc12
Show InChI InChI=1S/C20H14N4S2/c21-11-9-15-13-5-1-3-7-17(13)23-19(15)25-26-20-16(10-12-22)14-6-2-4-8-18(14)24-20/h1-8,23-24H,9-10H2
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n/an/a 2.50E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3998
PNG
(1 H-indole-3-alkanamide deriv. 10g | N-methoxy-3-[...)
Show SMILES CONC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NOC)[nH]c2ccccc12
Show InChI InChI=1S/C24H26N4O4S2/c1-31-27-21(29)13-11-17-15-7-3-5-9-19(15)25-23(17)33-34-24-18(12-14-22(30)28-32-2)16-8-4-6-10-20(16)26-24/h3-10,25-26H,11-14H2,1-2H3,(H,27,29)(H,28,30)
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n/an/a 2.90E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4001
PNG
(1 H-indole-3-alkanamide deriv. 10j | N-benzyl-3-[2...)
Show SMILES O=C(CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NCc2ccccc2)[nH]c2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C36H34N4O2S2/c41-33(37-23-25-11-3-1-4-12-25)21-19-29-27-15-7-9-17-31(27)39-35(29)43-44-36-30(28-16-8-10-18-32(28)40-36)20-22-34(42)38-24-26-13-5-2-6-14-26/h1-18,39-40H,19-24H2,(H,37,41)(H,38,42)
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n/an/a 2.90E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4013
PNG
(1 H-indole-3-alkanamide deriv. 11a | N-benzyl-2-(2...)
Show SMILES O=C(CC1C(=S)Nc2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C17H16N2OS/c20-16(18-11-12-6-2-1-3-7-12)10-14-13-8-4-5-9-15(13)19-17(14)21/h1-9,14H,10-11H2,(H,18,20)(H,19,21)
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n/an/a 3.20E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3981
PNG
(1 H-indole-3-alkanamide deriv. 7 | Dimethyl 2,2 -D...)
Show SMILES COC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)OC)[nH]c2ccccc12
Show InChI InChI=1S/C24H24N2O4S2/c1-29-21(27)13-11-17-15-7-3-5-9-19(15)25-23(17)31-32-24-18(12-14-22(28)30-2)16-8-4-6-10-20(16)26-24/h3-10,25-26H,11-14H2,1-2H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3990
PNG
(1 H-indole-3-alkanamide deriv. 10a | N-benzyl-2-[2...)
Show SMILES O=C(Cc1c(SSc2[nH]c3ccccc3c2CC(=O)NCc2ccccc2)[nH]c2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C34H30N4O2S2/c39-31(35-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-29(25)37-33(27)41-42-34-28(26-16-8-10-18-30(26)38-34)20-32(40)36-22-24-13-5-2-6-14-24/h1-18,37-38H,19-22H2,(H,35,39)(H,36,40)
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n/an/a 3.80E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4000
PNG
(1 H-indole-3-alkanamide deriv. 10i | 2,2-Dithiobis...)
Show SMILES O=C(CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)Nc2ccccc2)[nH]c2ccccc12)Nc1ccccc1
Show InChI InChI=1S/C34H30N4O2S2/c39-31(35-23-11-3-1-4-12-23)21-19-27-25-15-7-9-17-29(25)37-33(27)41-42-34-28(26-16-8-10-18-30(26)38-34)20-22-32(40)36-24-13-5-2-6-14-24/h1-18,37-38H,19-22H2,(H,35,39)(H,36,40)
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n/an/a 4.40E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3979
PNG
(2,2 -Dithiobis(1H-indole-3-propanoic acid) | 3-(2-...)
Show SMILES OC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(O)=O)[nH]c2ccccc12
Show InChI InChI=1S/C22H20N2O4S2/c25-19(26)11-9-15-13-5-1-3-7-17(13)23-21(15)29-30-22-16(10-12-20(27)28)14-6-2-4-8-18(14)24-22/h1-8,23-24H,9-12H2,(H,25,26)(H,27,28)
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n/an/a 4.80E+3n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4003
PNG
(1 H-indole-3-alkanamide deriv. 10l | 2,2 -Dithiobi...)
Show SMILES OC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(cc3)C(O)=O)[nH]c3ccccc23)cc1
Show InChI InChI=1S/C38H34N4O6S2/c43-33(39-21-23-9-13-25(14-10-23)37(45)46)19-17-29-27-5-1-3-7-31(27)41-35(29)49-50-36-30(28-6-2-4-8-32(28)42-36)18-20-34(44)40-22-24-11-15-26(16-12-24)38(47)48/h1-16,41-42H,17-22H2,(H,39,43)(H,40,44)(H,45,46)(H,47,48)
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n/an/a 7.40E+3n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3351
PNG
(2-amino-3-[2-({3-[2-amino-2-(benzylcarbamoyl)ethyl...)
Show SMILES NC(Cc1c(SSc2[nH]c3ccccc3c2CC(N)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C36H36N6O2S2/c37-29(33(43)39-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-31(25)41-35(27)45-46-36-28(26-16-8-10-18-32(26)42-36)20-30(38)34(44)40-22-24-13-5-2-6-14-24/h1-18,29-30,41-42H,19-22,37-38H2,(H,39,43)(H,40,44)
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n/an/a 7.60E+3n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4005
PNG
(1 H-indole-3-alkanamide deriv. 10n | 2,2 -Dithiobi...)
Show SMILES OC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(C(O)=O)c(O)c3)[nH]c3ccccc23)cc1O
Show InChI InChI=1S/C38H34N4O8S2/c43-31-17-21(9-11-27(31)37(47)48)19-39-33(45)15-13-25-23-5-1-3-7-29(23)41-35(25)51-52-36-26(24-6-2-4-8-30(24)42-36)14-16-34(46)40-20-22-10-12-28(38(49)50)32(44)18-22/h1-12,17-18,41-44H,13-16,19-20H2,(H,39,45)(H,40,46)(H,47,48)(H,49,50)
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n/an/a 8.50E+3n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4015
PNG
(1 H-indole-3-alkanamide deriv. 11j | N-benzyl-3-(2...)
Show SMILES O=C(CCC1C(=S)Nc2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C18H18N2OS/c21-17(19-12-13-6-2-1-3-7-13)11-10-15-14-8-4-5-9-16(14)20-18(15)22/h1-9,15H,10-12H2,(H,19,21)(H,20,22)
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n/an/a 9.30E+3n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3997
PNG
(1 H-indole-3-alkanamide deriv. 10f | N-methyl-3-[2...)
Show SMILES CNC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NC)[nH]c2ccccc12
Show InChI InChI=1S/C24H26N4O2S2/c1-25-21(29)13-11-17-15-7-3-5-9-19(15)27-23(17)31-32-24-18(12-14-22(30)26-2)16-8-4-6-10-20(16)28-24/h3-10,27-28H,11-14H2,1-2H3,(H,25,29)(H,26,30)
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n/an/a 9.40E+3n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3999
PNG
(1 H-indole-3-alkanamide deriv. 10h | 3-[2-({3-[2-(...)
Show SMILES CN(C)C(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)N(C)C)[nH]c2ccccc12
Show InChI InChI=1S/C26H30N4O2S2/c1-29(2)23(31)15-13-19-17-9-5-7-11-21(17)27-25(19)33-34-26-20(14-16-24(32)30(3)4)18-10-6-8-12-22(18)28-26/h5-12,27-28H,13-16H2,1-4H3
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n/an/a 1.20E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4006
PNG
(1 H-indole-3-alkanamide deriv. 10o | N-(2-phenylet...)
Show SMILES O=C(CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NCCc2ccccc2)[nH]c2ccccc12)NCCc1ccccc1
Show InChI InChI=1S/C38H38N4O2S2/c43-35(39-25-23-27-11-3-1-4-12-27)21-19-31-29-15-7-9-17-33(29)41-37(31)45-46-38-32(30-16-8-10-18-34(30)42-38)20-22-36(44)40-26-24-28-13-5-2-6-14-28/h1-18,41-42H,19-26H2,(H,39,43)(H,40,44)
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n/an/a 1.40E+4n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4011
PNG
(1 H-indole-3-alkanamide deriv. 10t | 2,2 -Dithiobi...)
Show SMILES OC(Cc1c(SSc2[nH]c3ccccc3c2CC(O)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C36H34N4O4S2/c41-31(33(43)37-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-29(25)39-35(27)45-46-36-28(26-16-8-10-18-30(26)40-36)20-32(42)34(44)38-22-24-13-5-2-6-14-24/h1-18,31-32,39-42H,19-22H2,(H,37,43)(H,38,44)
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n/an/a 1.40E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3996
PNG
(1 H-indole-3-alkanamide deriv. 10e | 2,2 -Dithiobi...)
Show SMILES NC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(N)=O)[nH]c2ccccc12
Show InChI InChI=1S/C22H22N4O2S2/c23-19(27)11-9-15-13-5-1-3-7-17(13)25-21(15)29-30-22-16(10-12-20(24)28)14-6-2-4-8-18(14)26-22/h1-8,25-26H,9-12H2,(H2,23,27)(H2,24,28)
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n/an/a 1.60E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3981
PNG
(1 H-indole-3-alkanamide deriv. 7 | Dimethyl 2,2 -D...)
Show SMILES COC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)OC)[nH]c2ccccc12
Show InChI InChI=1S/C24H24N2O4S2/c1-29-21(27)13-11-17-15-7-3-5-9-19(15)25-23(17)31-32-24-18(12-14-22(28)30-2)16-8-4-6-10-20(16)26-24/h3-10,25-26H,11-14H2,1-2H3
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n/an/a 2.10E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4014
PNG
(1 H-indole-3-alkanamide deriv. 11e | 2,3-Dihydro-2...)
Show SMILES NC(=O)CCC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C11H12N2OS/c12-10(14)6-5-8-7-3-1-2-4-9(7)13-11(8)15/h1-4,8H,5-6H2,(H2,12,14)(H,13,15)
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n/an/a 2.20E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4006
PNG
(1 H-indole-3-alkanamide deriv. 10o | N-(2-phenylet...)
Show SMILES O=C(CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NCCc2ccccc2)[nH]c2ccccc12)NCCc1ccccc1
Show InChI InChI=1S/C38H38N4O2S2/c43-35(39-25-23-27-11-3-1-4-12-27)21-19-31-29-15-7-9-17-33(29)41-37(31)45-46-38-32(30-16-8-10-18-34(30)42-38)20-22-36(44)40-26-24-28-13-5-2-6-14-28/h1-18,41-42H,19-26H2,(H,39,43)(H,40,44)
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n/an/a 2.40E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4000
PNG
(1 H-indole-3-alkanamide deriv. 10i | 2,2-Dithiobis...)
Show SMILES O=C(CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)Nc2ccccc2)[nH]c2ccccc12)Nc1ccccc1
Show InChI InChI=1S/C34H30N4O2S2/c39-31(35-23-11-3-1-4-12-23)21-19-27-25-15-7-9-17-29(25)37-33(27)41-42-34-28(26-16-8-10-18-30(26)38-34)20-22-32(40)36-24-13-5-2-6-14-24/h1-18,37-38H,19-22H2,(H,35,39)(H,36,40)
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n/an/a 2.50E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4010
PNG
(1 H-indole-3-alkanamide deriv. 10s | 1-(benzylcarb...)
Show SMILES CC(=O)OC(Cc1c(SSc2[nH]c3ccccc3c2CC(OC(C)=O)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C40H38N4O6S2/c1-25(45)49-35(37(47)41-23-27-13-5-3-6-14-27)21-31-29-17-9-11-19-33(29)43-39(31)51-52-40-32(30-18-10-12-20-34(30)44-40)22-36(50-26(2)46)38(48)42-24-28-15-7-4-8-16-28/h3-20,35-36,43-44H,21-24H2,1-2H3,(H,41,47)(H,42,48)
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n/an/a 2.80E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3991
PNG
(1 H-indole-3-alkanamide deriv. 10b | 2-(2-{[3-(cya...)
Show SMILES N#CCc1c(SSc2[nH]c3ccccc3c2CC#N)[nH]c2ccccc12
Show InChI InChI=1S/C20H14N4S2/c21-11-9-15-13-5-1-3-7-17(13)23-19(15)25-26-20-16(10-12-22)14-6-2-4-8-18(14)24-20/h1-8,23-24H,9-10H2
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n/an/a 3.20E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3990
PNG
(1 H-indole-3-alkanamide deriv. 10a | N-benzyl-2-[2...)
Show SMILES O=C(Cc1c(SSc2[nH]c3ccccc3c2CC(=O)NCc2ccccc2)[nH]c2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C34H30N4O2S2/c39-31(35-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-29(25)37-33(27)41-42-34-28(26-16-8-10-18-30(26)38-34)20-32(40)36-22-24-13-5-2-6-14-24/h1-18,37-38H,19-22H2,(H,35,39)(H,36,40)
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n/an/a 3.80E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4002
PNG
(1 H-indole-3-alkanamide deriv. 10k | 2,2 -dithiobi...)
Show SMILES COC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(cc3)C(=O)OC)[nH]c3ccccc23)cc1
Show InChI InChI=1S/C40H38N4O6S2/c1-49-39(47)27-15-11-25(12-16-27)23-41-35(45)21-19-31-29-7-3-5-9-33(29)43-37(31)51-52-38-32(30-8-4-6-10-34(30)44-38)20-22-36(46)42-24-26-13-17-28(18-14-26)40(48)50-2/h3-18,43-44H,19-24H2,1-2H3,(H,41,45)(H,42,46)
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n/an/a 4.40E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3994
PNG
(1 H-indole-3-alkanamide deriv. 10c | 3-(2-{[3-(2-c...)
Show SMILES N#CCCc1c(SSc2[nH]c3ccccc3c2CCC#N)[nH]c2ccccc12
Show InChI InChI=1S/C22H18N4S2/c23-13-5-9-17-15-7-1-3-11-19(15)25-21(17)27-28-22-18(10-6-14-24)16-8-2-4-12-20(16)26-22/h1-4,7-8,11-12,25-26H,5-6,9-10H2
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n/an/a 4.70E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM3979
PNG
(2,2 -Dithiobis(1H-indole-3-propanoic acid) | 3-(2-...)
Show SMILES OC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(O)=O)[nH]c2ccccc12
Show InChI InChI=1S/C22H20N2O4S2/c25-19(26)11-9-15-13-5-1-3-7-17(13)23-21(15)29-30-22-16(10-12-20(27)28)14-6-2-4-8-18(14)24-22/h1-8,23-24H,9-12H2,(H,25,26)(H,27,28)
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n/an/a 5.10E+4n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4007
PNG
(1 H-indole-3-alkanamide deriv. 10p | 2,2 -Dithiobi...)
Show SMILES CC(=O)NC(Cc1c(SSc2[nH]c3ccccc3c2CC(NC(C)=O)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C40H40N6O4S2/c1-25(47)43-35(37(49)41-23-27-13-5-3-6-14-27)21-31-29-17-9-11-19-33(29)45-39(31)51-52-40-32(30-18-10-12-20-34(30)46-40)22-36(44-26(2)48)38(50)42-24-28-15-7-4-8-16-28/h3-20,35-36,45-46H,21-24H2,1-2H3,(H,41,49)(H,42,50)(H,43,47)(H,44,48)
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n/an/a 5.10E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3998
PNG
(1 H-indole-3-alkanamide deriv. 10g | N-methoxy-3-[...)
Show SMILES CONC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(=O)NOC)[nH]c2ccccc12
Show InChI InChI=1S/C24H26N4O4S2/c1-31-27-21(29)13-11-17-15-7-3-5-9-19(15)25-23(17)33-34-24-18(12-14-22(30)28-32-2)16-8-4-6-10-20(16)26-24/h3-10,25-26H,11-14H2,1-2H3,(H,27,29)(H,28,30)
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n/an/a 6.80E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3995
PNG
(1 H-indole-3-alkanamide deriv. 10d | 3-(2-nitroeth...)
Show SMILES [O-][N+](=O)CCc1c(SSc2[nH]c3ccccc3c2CC[N+]([O-])=O)[nH]c2ccccc12
Show InChI InChI=1S/C20H18N4O4S2/c25-23(26)11-9-15-13-5-1-3-7-17(13)21-19(15)29-30-20-16(10-12-24(27)28)14-6-2-4-8-18(14)22-20/h1-8,21-22H,9-12H2
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n/an/a 8.90E+4n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4008
PNG
(1 H-indole-3-alkanamide deriv. 10q | 2,2-Dithiobis...)
Show SMILES FC(F)(F)C(=O)NC(Cc1c(SSc2[nH]c3ccccc3c2CC(NC(=O)C(F)(F)F)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Show InChI InChI=1S/C40H34F6N6O4S2/c41-39(42,43)37(55)51-31(33(53)47-21-23-11-3-1-4-12-23)19-27-25-15-7-9-17-29(25)49-35(27)57-58-36-28(26-16-8-10-18-30(26)50-36)20-32(52-38(56)40(44,45)46)34(54)48-22-24-13-5-2-6-14-24/h1-18,31-32,49-50H,19-22H2,(H,47,53)(H,48,54)(H,51,55)(H,52,56)
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n/an/a>1.00E+5n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4004
PNG
(1 H-indole-3-alkanamide deriv. 10m | 2,2 -Dithiobi...)
Show SMILES COC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(C(=O)OC)c(O)c3)[nH]c3ccccc23)cc1O
Show InChI InChI=1S/C40H38N4O8S2/c1-51-39(49)29-13-11-23(19-33(29)45)21-41-35(47)17-15-27-25-7-3-5-9-31(25)43-37(27)53-54-38-28(26-8-4-6-10-32(26)44-38)16-18-36(48)42-22-24-12-14-30(34(46)20-24)40(50)52-2/h3-14,19-20,43-46H,15-18,21-22H2,1-2H3,(H,41,47)(H,42,48)
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n/an/a 1.00E+5n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4013
PNG
(1 H-indole-3-alkanamide deriv. 11a | N-benzyl-2-(2...)
Show SMILES O=C(CC1C(=S)Nc2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C17H16N2OS/c20-16(18-11-12-6-2-1-3-7-12)10-14-13-8-4-5-9-15(13)19-17(14)21/h1-9,14H,10-11H2,(H,18,20)(H,19,21)
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n/an/a 1.00E+5n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase transforming protein Src


(Avian sarcoma virus)		BDBM4004
PNG
(1 H-indole-3-alkanamide deriv. 10m | 2,2 -Dithiobi...)
Show SMILES COC(=O)c1ccc(CNC(=O)CCc2c(SSc3[nH]c4ccccc4c3CCC(=O)NCc3ccc(C(=O)OC)c(O)c3)[nH]c3ccccc23)cc1O
Show InChI InChI=1S/C40H38N4O8S2/c1-51-39(49)29-13-11-23(19-33(29)45)21-41-35(47)17-15-27-25-7-3-5-9-31(25)43-37(27)53-54-38-28(26-8-4-6-10-32(26)44-38)16-18-36(48)42-22-24-12-14-30(34(46)20-24)40(50)52-2/h3-14,19-20,43-46H,15-18,21-22H2,1-2H3,(H,41,47)(H,42,48)
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4015
PNG
(1 H-indole-3-alkanamide deriv. 11j | N-benzyl-3-(2...)
Show SMILES O=C(CCC1C(=S)Nc2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C18H18N2OS/c21-17(19-12-13-6-2-1-3-7-13)11-10-15-14-8-4-5-9-16(14)20-18(15)22/h1-9,15H,10-12H2,(H,19,21)(H,20,22)
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n/an/a 1.00E+5n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM4012
PNG
(1 H-indole-3-alkanamide deriv. 10u | N-benzyl-4-[2...)
Show SMILES O=C(CCCc1c(SSc2[nH]c3ccccc3c2CCCC(=O)NCc2ccccc2)[nH]c2ccccc12)NCc1ccccc1
Show InChI InChI=1S/C38H38N4O2S2/c43-35(39-25-27-13-3-1-4-14-27)23-11-19-31-29-17-7-9-21-33(29)41-37(31)45-46-38-32(30-18-8-10-22-34(30)42-38)20-12-24-36(44)40-26-28-15-5-2-6-16-28/h1-10,13-18,21-22,41-42H,11-12,19-20,23-26H2,(H,39,43)(H,40,44)
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n/an/a 1.00E+5n/an/an/an/a7.422



University of Auckland



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...

J Med Chem 37: 598-609 (1994)


Article DOI: 10.1021/jm00031a009
BindingDB Entry DOI: 10.7270/Q2MS3QZH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%