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PubMed code 8355247

Compile data set for download or QSAR
Found 34 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
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3985
PNG
(2,2 -Dithiobis(7-methyl-1H-indole-3-propanoic acid...)
Show SMILES Cc1cccc2c(CCC(O)=O)c(SSc3[nH]c4c(C)cccc4c3CCC(O)=O)[nH]c12
Show InChI InChI=1S/C24H24N2O4S2/c1-13-5-3-7-15-17(9-11-19(27)28)23(25-21(13)15)31-32-24-18(10-12-20(29)30)16-8-4-6-14(2)22(16)26-24/h3-8,25-26H,9-12H2,1-2H3,(H,27,28)(H,29,30)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3960
PNG
(2,3-Dihydro-2-thioxo-1H-indole-3-propanoic Acid | ...)
Show SMILES OC(=O)CCC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C11H11NO2S/c13-10(14)6-5-8-7-3-1-2-4-9(7)12-11(8)15/h1-4,8H,5-6H2,(H,12,15)(H,13,14)
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n/an/a 1.62E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3973
PNG
(N-[(E)-2-(2,5-dihydroxyphenyl)ethenyl]formamide | ...)
Show SMILES Oc1ccc(O)c(\C=C\NC=O)c1
Show InChI InChI=1S/C9H9NO3/c11-6-10-4-3-7-5-8(12)1-2-9(7)13/h1-6,12-13H,(H,10,11)/b4-3+
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n/an/a 2.00E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3984
PNG
(2,2 -Dithiobis(6-methyl-1H-indole-3-propanoic acid...)
Show SMILES Cc1ccc2c(CCC(O)=O)c(SSc3[nH]c4cc(C)ccc4c3CCC(O)=O)[nH]c2c1
Show InChI InChI=1S/C24H24N2O4S2/c1-13-3-5-15-17(7-9-21(27)28)23(25-19(15)11-13)31-32-24-18(8-10-22(29)30)16-6-4-14(2)12-20(16)26-24/h3-6,11-12,25-26H,7-10H2,1-2H3,(H,27,28)(H,29,30)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3980
PNG
(2,2 -Dithiobis(1-methyl-1H-indole-3-propanoic acid...)
Show SMILES Cn1c(SSc2c(CCC(O)=O)c3ccccc3n2C)c(CCC(O)=O)c2ccccc12
Show InChI InChI=1S/C24H24N2O4S2/c1-25-19-9-5-3-7-15(19)17(11-13-21(27)28)23(25)31-32-24-18(12-14-22(29)30)16-8-4-6-10-20(16)26(24)2/h3-10H,11-14H2,1-2H3,(H,27,28)(H,29,30)
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n/an/a 3.10E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
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 4.20E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3964
PNG
(2,3-Dihydro-2-thioxo-1H-indole-3-butanoic Acid | 2...)
Show SMILES OC(=O)CCCC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C12H13NO2S/c14-11(15)7-3-5-9-8-4-1-2-6-10(8)13-12(9)16/h1-2,4,6,9H,3,5,7H2,(H,13,16)(H,14,15)
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n/an/a 6.70E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3961
PNG
(2,3-Dihydro-1-methyl-2-thioxo-1H-indole-3-propanoi...)
Show SMILES CN1C(=S)C(CCC(O)=O)c2ccccc12
Show InChI InChI=1S/C12H13NO2S/c1-13-10-5-3-2-4-8(10)9(12(13)16)6-7-11(14)15/h2-5,9H,6-7H2,1H3,(H,14,15)
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n/an/a 6.70E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3987
PNG
(2,2 -Dithiobis(1-methyl-1H-indole-3-butanoic acid)...)
Show SMILES Cn1c(SSc2c(CCCC(O)=O)c3ccccc3n2C)c(CCCC(O)=O)c2ccccc12
Show InChI InChI=1S/C26H28N2O4S2/c1-27-21-13-5-3-9-17(21)19(11-7-15-23(29)30)25(27)33-34-26-20(12-8-16-24(31)32)18-10-4-6-14-22(18)28(26)2/h3-6,9-10,13-14H,7-8,11-12,15-16H2,1-2H3,(H,29,30)(H,31,32)
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n/an/a 8.30E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3983
PNG
(2,2 -Dithiobis(5-methyl-1H-indole-3-propanoic acid...)
Show SMILES Cc1ccc2[nH]c(SSc3[nH]c4ccc(C)cc4c3CCC(O)=O)c(CCC(O)=O)c2c1
Show InChI InChI=1S/C24H24N2O4S2/c1-13-3-7-19-17(11-13)15(5-9-21(27)28)23(25-19)31-32-24-16(6-10-22(29)30)18-12-14(2)4-8-20(18)26-24/h3-4,7-8,11-12,25-26H,5-6,9-10H2,1-2H3,(H,27,28)(H,29,30)
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n/an/a 8.40E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3977
PNG
(2,2 -Trithiobis( 1H-indole-3-acetic acid) | 2-[2-(...)
Show SMILES OC(=O)Cc1c(SSSc2[nH]c3ccccc3c2CC(O)=O)[nH]c2ccccc12
Show InChI InChI=1S/C20H16N2O4S3/c23-17(24)9-13-11-5-1-3-7-15(11)21-19(13)27-29-28-20-14(10-18(25)26)12-6-2-4-8-16(12)22-20/h1-8,21-22H,9-10H2,(H,23,24)(H,25,26)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3971
PNG
(2,2 -Dithiobis(1H-indole-3-acetic acid) | 2-(2-{[3...)
Show SMILES OC(=O)Cc1c(SSc2[nH]c3ccccc3c2CC(O)=O)[nH]c2ccccc12
Show InChI InChI=1S/C20H16N2O4S2/c23-17(24)9-13-11-5-1-3-7-15(11)21-19(13)27-28-20-14(10-18(25)26)12-6-2-4-8-16(12)22-20/h1-8,21-22H,9-10H2,(H,23,24)(H,25,26)
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n/an/a 1.02E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3956
PNG
((2-thioxo-2,3-dihydro-1H-indol-3-yl)acetic acid | ...)
Show SMILES OC(=O)CC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C10H9NO2S/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)
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n/an/a 1.49E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3974
PNG
(Dimethyl 2,2 -Dithiobis(1H-indole-3-acetate) | dit...)
Show SMILES COC(=O)Cc1c(SSc2[nH]c3ccccc3c2CC(=O)OC)[nH]c2ccccc12
Show InChI InChI=1S/C22H20N2O4S2/c1-27-19(25)11-15-13-7-3-5-9-17(13)23-21(15)29-30-22-16(12-20(26)28-2)14-8-4-6-10-18(14)24-22/h3-10,23-24H,11-12H2,1-2H3
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n/an/a 1.80E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3986
PNG
(2,2 -Dithiobis(1H-indole-3-butanoic acid) | 4-(2-{...)
Show SMILES OC(=O)CCCc1c(SSc2[nH]c3ccccc3c2CCCC(O)=O)[nH]c2ccccc12
Show InChI InChI=1S/C24H24N2O4S2/c27-21(28)13-5-9-17-15-7-1-3-11-19(15)25-23(17)31-32-24-18(10-6-14-22(29)30)16-8-2-4-12-20(16)26-24/h1-4,7-8,11-12,25-26H,5-6,9-10,13-14H2,(H,27,28)(H,29,30)
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n/an/a 1.80E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
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/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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3975
PNG
(Dimethyl 2,2 -Dithiobis(1-methyl-1H-indole-3-aceta...)
Show SMILES COC(=O)Cc1c(SSc2c(CC(=O)OC)c3ccccc3n2C)n(C)c2ccccc12
Show InChI InChI=1S/C24H24N2O4S2/c1-25-19-11-7-5-9-15(19)17(13-21(27)29-3)23(25)31-32-24-18(14-22(28)30-4)16-10-6-8-12-20(16)26(24)2/h5-12H,13-14H2,1-4H3
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n/an/a 3.30E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3978
PNG
(Dimethyl 2,2 -Trithiobis(1H-indole-3-acetate) | di...)
Show SMILES COC(=O)Cc1c(SSSc2[nH]c3ccccc3c2CC(=O)OC)[nH]c2ccccc12
Show InChI InChI=1S/C22H20N2O4S3/c1-27-19(25)11-15-13-7-3-5-9-17(13)23-21(15)29-31-30-22-16(12-20(26)28-2)14-8-4-6-10-18(14)24-22/h3-10,23-24H,11-12H2,1-2H3
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n/an/a 3.50E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3972
PNG
(2,2 -Dithiobis(1-methyl-1H-indole-3-acetic acid) |...)
Show SMILES Cn1c(SSc2c(CC(O)=O)c3ccccc3n2C)c(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C22H20N2O4S2/c1-23-17-9-5-3-7-13(17)15(11-19(25)26)21(23)29-30-22-16(12-20(27)28)14-8-4-6-10-18(14)24(22)2/h3-10H,11-12H2,1-2H3,(H,25,26)(H,27,28)
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n/an/a 5.30E+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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3968
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 17 | 3-[...)
Show SMILES OC(=O)CCC1(CCC(O)=O)C(=S)Nc2ccccc12
Show InChI InChI=1S/C14H15NO4S/c16-11(17)5-7-14(8-6-12(18)19)9-3-1-2-4-10(9)15-13(14)20/h1-4H,5-8H2,(H,15,20)(H,16,17)(H,18,19)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3965
PNG
(2,3-Dihydro-1-methyl-2-thioxo-1H-indole-3-butanoic...)
Show SMILES CN1C(=S)C(CCCC(O)=O)c2ccccc12
Show InChI InChI=1S/C13H15NO2S/c1-14-11-7-3-2-5-9(11)10(13(14)17)6-4-8-12(15)16/h2-3,5,7,10H,4,6,8H2,1H3,(H,15,16)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3982
PNG
(CHEMBL314029 | Dimethyl 2,2 -dithiobis(1-methyl-1H...)
Show SMILES COC(=O)CCc1c(SSc2c(CCC(=O)OC)c3ccccc3n2C)n(C)c2ccccc12
Show InChI InChI=1S/C26H28N2O4S2/c1-27-21-11-7-5-9-17(21)19(13-15-23(29)31-3)25(27)33-34-26-20(14-16-24(30)32-4)18-10-6-8-12-22(18)28(26)2/h5-12H,13-16H2,1-4H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3957
PNG
(2,3-Dihydro-1-methyl-2-thioxo-1H-indole-3-acetic A...)
Show SMILES CN1C(=S)C(CC(O)=O)c2ccccc12
Show InChI InChI=1S/C11H11NO2S/c1-12-9-5-3-2-4-7(9)8(11(12)15)6-10(13)14/h2-5,8H,6H2,1H3,(H,13,14)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3976
PNG
(Dimethyl 2,2 -Thiobis(1-methyl-1H-indole-3-acetate...)
Show SMILES COC(=O)Cc1c(Sc2c(CC(=O)OC)c3ccccc3n2C)n(C)c2ccccc12
Show InChI InChI=1S/C24H24N2O4S/c1-25-19-11-7-5-9-15(19)17(13-21(27)29-3)23(25)31-24-18(14-22(28)30-4)16-10-6-8-12-20(16)26(24)2/h5-12H,13-14H2,1-4H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3969
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 18 | Dim...)
Show SMILES COC(=O)CCC1(CCC(=O)OC)C(=S)Nc2ccccc12
Show InChI InChI=1S/C16H19NO4S/c1-20-13(18)7-9-16(10-8-14(19)21-2)11-5-3-4-6-12(11)17-15(16)22/h3-6H,7-10H2,1-2H3,(H,17,22)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3967
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 16 | Met...)
Show SMILES COC(=O)CCCC1C(=S)N(C)c2ccccc12
Show InChI InChI=1S/C14H17NO2S/c1-15-12-8-4-3-6-10(12)11(14(15)18)7-5-9-13(16)17-2/h3-4,6,8,11H,5,7,9H2,1-2H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3966
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 15 | Met...)
Show SMILES COC(=O)CCCC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C13H15NO2S/c1-16-12(15)8-4-6-10-9-5-2-3-7-11(9)14-13(10)17/h2-3,5,7,10H,4,6,8H2,1H3,(H,14,17)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3962
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 11 | Met...)
Show SMILES COC(=O)CCC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C12H13NO2S/c1-15-11(14)7-6-9-8-4-2-3-5-10(8)13-12(9)16/h2-5,9H,6-7H2,1H3,(H,13,16)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3958
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 7 | Meth...)
Show SMILES COC(=O)CC1C(=S)Nc2ccccc12
Show InChI InChI=1S/C11H11NO2S/c1-14-10(13)6-8-7-4-2-3-5-9(7)12-11(8)15/h2-5,8H,6H2,1H3,(H,12,15)
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3970
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 19 | Tri...)
Show SMILES COC(=O)CCN1C(=S)C(CCC(=O)OC)(CCC(=O)OC)c2ccccc12
Show InChI InChI=1S/C20H25NO6S/c1-25-16(22)8-11-20(12-9-17(23)26-2)14-6-4-5-7-15(14)21(19(20)28)13-10-18(24)27-3/h4-7H,8-13H2,1-3H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3959
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 8 | Meth...)
Show SMILES COC(=O)CC1C(=S)N(C)c2ccccc12
Show InChI InChI=1S/C12H13NO2S/c1-13-10-6-4-3-5-8(10)9(12(13)16)7-11(14)15-2/h3-6,9H,7H2,1-2H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3988
PNG
(Dimethyl 2,2 -Dithiobis(1H-indole-3-butanoate) | d...)
Show SMILES COC(=O)CCCc1c(SSc2[nH]c3ccccc3c2CCCC(=O)OC)[nH]c2ccccc12
Show InChI InChI=1S/C26H28N2O4S2/c1-31-23(29)15-7-11-19-17-9-3-5-13-21(17)27-25(19)33-34-26-20(12-8-16-24(30)32-2)18-10-4-6-14-22(18)28-26/h3-6,9-10,13-14,27-28H,7-8,11-12,15-16H2,1-2H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3989
PNG
(Dimethyl 2,2 -Dithiobis(1-methyl-1H-indole-3-butan...)
Show SMILES COC(=O)CCCc1c(SSc2c(CCCC(=O)OC)c3ccccc3n2C)n(C)c2ccccc12
Show InChI InChI=1S/C28H32N2O4S2/c1-29-23-15-7-5-11-19(23)21(13-9-17-25(31)33-3)27(29)35-36-28-22(14-10-18-26(32)34-4)20-12-6-8-16-24(20)30(28)2/h5-8,11-12,15-16H,9-10,13-14,17-18H2,1-4H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM3963
PNG
(2-thioxo-1H-indole-3-alkanoic acid deriv. 12 | Met...)
Show SMILES COC(=O)CCC1C(=S)N(C)c2ccccc12
Show InChI InChI=1S/C13H15NO2S/c1-14-11-6-4-3-5-9(11)10(13(14)17)7-8-12(15)16-2/h3-6,10H,7-8H2,1-2H3
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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 36: 2459-69 (1993)


Article DOI: 10.1021/jm00069a003
BindingDB Entry DOI: 10.7270/Q2RJ4GNS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%