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PubMed code 11078204

Compile data set for download or QSAR
Found 19 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))
BDBM6503
PNG
(4-Anilino-3-cyanoquinoline deriv. 4 | 6,7-dimethox...)
Show SMILES COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc(OC)c1OC
Show InChI InChI=1S/C21H21N3O5/c1-25-16-8-14-15(9-17(16)26-2)23-11-12(10-22)20(14)24-13-6-18(27-3)21(29-5)19(7-13)28-4/h6-9,11H,1-5H3,(H,23,24)
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PubMed
n/an/a 35n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6504
PNG
(4-Anilino-3-cyanoquinoline deriv. 7a | 4-[(4-ethox...)
Show SMILES CCOc1c(OC)cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc1OC
Show InChI InChI=1S/C22H23N3O5/c1-6-30-22-19(28-4)7-14(8-20(22)29-5)25-21-13(11-23)12-24-16-10-18(27-3)17(26-2)9-15(16)21/h7-10,12H,6H2,1-5H3,(H,24,25)
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n/an/a 63n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6505
PNG
(4-Anilino-3-cyanoquinoline deriv. 7b | 4-{[3,5-dim...)
Show SMILES COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC(C)C)c(OC)c3)c2cc1OC
Show InChI InChI=1S/C23H25N3O5/c1-13(2)31-23-20(29-5)7-15(8-21(23)30-6)26-22-14(11-24)12-25-17-10-19(28-4)18(27-3)9-16(17)22/h7-10,12-13H,1-6H3,(H,25,26)
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n/an/a 110n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6510
PNG
(4-Anilino-3-cyanoquinoline deriv. 7g | 4-[(2-bromo...)
Show SMILES COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3Br)c2cc1OC
Show InChI InChI=1S/C21H20BrN3O5/c1-26-15-6-12-13(7-16(15)27-2)24-10-11(9-23)19(12)25-14-8-17(28-3)20(29-4)21(30-5)18(14)22/h6-8,10H,1-5H3,(H,24,25)
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n/an/a 170n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6506
PNG
(4-Anilino-3-cyanoquinoline deriv. 7c | 4-{[4-(dode...)
Show SMILES CCCCCCCCCCCCOc1c(OC)cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc1OC
Show InChI InChI=1S/C32H43N3O5/c1-6-7-8-9-10-11-12-13-14-15-16-40-32-29(38-4)17-24(18-30(32)39-5)35-31-23(21-33)22-34-26-20-28(37-3)27(36-2)19-25(26)31/h17-20,22H,6-16H2,1-5H3,(H,34,35)
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n/an/a 180n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6511
PNG
(4-Anilinoquinoline deriv. 8 | 6,7-dimethoxy-N-(3,4...)
Show SMILES COc1cc(Nc2ccnc3cc(OC)c(OC)cc23)cc(OC)c1OC
Show InChI InChI=1S/C20H22N2O5/c1-23-16-10-13-14(6-7-21-15(13)11-17(16)24-2)22-12-8-18(25-3)20(27-5)19(9-12)26-4/h6-11H,1-5H3,(H,21,22)
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n/an/a 200n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6497
PNG
(6,7-dimethoxy-N-(3,4,5-trimethoxyphenyl)quinazolin...)
Show SMILES COc1cc2ncnc(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC
Show InChI InChI=1S/C19H21N3O5/c1-23-14-8-12-13(9-15(14)24-2)20-10-21-19(12)22-11-6-16(25-3)18(27-5)17(7-11)26-4/h6-10H,1-5H3,(H,20,21,22)
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n/an/a 280n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6514
PNG
(3-cyanoquinoline deriv. 11 | 6,7-dimethoxy-4-(3,4,...)
Show SMILES COc1cc(Oc2c(cnc3cc(OC)c(OC)cc23)C#N)cc(OC)c1OC
Show InChI InChI=1S/C21H20N2O6/c1-24-16-8-14-15(9-17(16)25-2)23-11-12(10-22)20(14)29-13-6-18(26-3)21(28-5)19(7-13)27-4/h6-9,11H,1-5H3
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n/an/a 290n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6498
PNG
(4-Anilinoquinazoline deriv. 6a | N-(4-ethoxy-3,5-d...)
Show SMILES CCOc1c(OC)cc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C20H23N3O5/c1-6-28-19-17(26-4)7-12(8-18(19)27-5)23-20-13-9-15(24-2)16(25-3)10-14(13)21-11-22-20/h7-11H,6H2,1-5H3,(H,21,22,23)
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n/an/a 340n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6509
PNG
(4-Anilino-3-cyanoquinoline deriv. 7f | 6,7-dimetho...)
Show SMILES COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3C)c2cc1OC
Show InChI InChI=1S/C22H23N3O5/c1-12-15(8-19(28-4)22(30-6)21(12)29-5)25-20-13(10-23)11-24-16-9-18(27-3)17(26-2)7-14(16)20/h7-9,11H,1-6H3,(H,24,25)
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n/an/a 470n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6499
PNG
(4-Anilinoquinazoline deriv. 6b | N-(4-butoxy-3,5-d...)
Show SMILES CCCCOc1c(OC)cc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C22H27N3O5/c1-6-7-8-30-21-19(28-4)9-14(10-20(21)29-5)25-22-15-11-17(26-2)18(27-3)12-16(15)23-13-24-22/h9-13H,6-8H2,1-5H3,(H,23,24,25)
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n/an/a 490n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6500
PNG
(4-Anilinoquinazoline deriv. 6c | N-[3,5-dimethoxy-...)
Show SMILES COc1cc2ncnc(Nc3cc(OC)c(OC(C)C)c(OC)c3)c2cc1OC
Show InChI InChI=1S/C21H25N3O5/c1-12(2)29-20-18(27-5)7-13(8-19(20)28-6)24-21-14-9-16(25-3)17(26-4)10-15(14)22-11-23-21/h7-12H,1-6H3,(H,22,23,24)
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n/an/a 830n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM4448
PNG
(4-(3,4-Dimethoxyphenylamino)-6,7-dimethoxyquinolin...)
Show SMILES COc1ccc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc1OC
Show InChI InChI=1S/C20H19N3O4/c1-24-16-6-5-13(7-17(16)25-2)23-20-12(10-21)11-22-15-9-19(27-4)18(26-3)8-14(15)20/h5-9,11H,1-4H3,(H,22,23)
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n/an/a 950n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6507
PNG
(4-Anilino-3-cyanoquinoline deriv. 7d | 4-[(3,5-dim...)
Show SMILES COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc(OC)c1
Show InChI InChI=1S/C20H19N3O4/c1-24-14-5-13(6-15(7-14)25-2)23-20-12(10-21)11-22-17-9-19(27-4)18(26-3)8-16(17)20/h5-9,11H,1-4H3,(H,22,23)
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n/an/a 980n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6501
PNG
(4-Anilinoquinazoline deriv. 6d | N-[4-(tert-butoxy...)
Show SMILES COc1cc(Nc2ncnc3cc(OC)c(OC)cc23)cc(OC)c1OC(C)(C)C
Show InChI InChI=1S/C22H27N3O5/c1-22(2,3)30-20-18(28-6)8-13(9-19(20)29-7)25-21-14-10-16(26-4)17(27-5)11-15(14)23-12-24-21/h8-12H,1-7H3,(H,23,24,25)
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n/an/a 2.70E+3n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6502
PNG
(4-Anilinoquinazoline deriv. 6e | N-[4-(dodecyloxy)...)
Show SMILES CCCCCCCCCCCCOc1c(OC)cc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C30H43N3O5/c1-6-7-8-9-10-11-12-13-14-15-16-38-29-27(36-4)17-22(18-28(29)37-5)33-30-23-19-25(34-2)26(35-3)20-24(23)31-21-32-30/h17-21H,6-16H2,1-5H3,(H,31,32,33)
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n/an/a 5.20E+3n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6515
PNG
(3-cyanoquinoline deriv. 12 | 6,7-dimethoxy-4-{[(3,...)
Show SMILES COc1cc2ncc(C#N)c(NCc3cc(OC)c(OC)c(OC)c3)c2cc1OC
Show InChI InChI=1S/C22H23N3O5/c1-26-17-8-15-16(9-18(17)27-2)24-12-14(10-23)21(15)25-11-13-6-19(28-3)22(30-5)20(7-13)29-4/h6-9,12H,11H2,1-5H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6513
PNG
(4-Anilinoquinoline deriv. 10 | {6,7-dimethoxy-4-[(...)
Show SMILES COc1cc(Nc2c(CO)cnc3cc(OC)c(OC)cc23)cc(OC)c1OC
Show InChI InChI=1S/C21H24N2O6/c1-25-16-8-14-15(9-17(16)26-2)22-10-12(11-24)20(14)23-13-6-18(27-3)21(29-5)19(7-13)28-4/h6-10,24H,11H2,1-5H3,(H,22,23)
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n/an/a>1.00E+4n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM6512
PNG
(4-Anilinoquinoline deriv. 9 | ethyl 6,7-dimethoxy-...)
Show SMILES CCOC(=O)c1cnc2cc(OC)c(OC)cc2c1Nc1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C23H26N2O7/c1-7-32-23(26)15-12-24-16-11-18(28-3)17(27-2)10-14(16)21(15)25-13-8-19(29-4)22(31-6)20(9-13)30-5/h8-12H,7H2,1-6H3,(H,24,25)
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PubMed
n/an/a>1.00E+4n/an/an/an/a7.530



Wyeth-Ayerst Research



Assay Description
Src kinase activity was measured in an ELISA format. IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the tra...


Bioorg Med Chem Lett 10: 2477-80 (2000)


Article DOI: 10.1016/S0960-894X(00)00493-5
BindingDB Entry DOI: 10.7270/Q20P0X7T
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%