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PubMed code 16789733

Compile data set for download or QSAR
Found 41 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
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189609
PNG
(CHEMBL209555 | N-cyclopropyl-4-fluoro-3-(2-(2-(pyr...)
Show SMILES Fc1ccc(cc1CCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C20H19FN4OS/c21-17-9-5-14(19(26)24-15-6-7-15)11-13(17)4-8-16-12-23-20(27-16)25-18-3-1-2-10-22-18/h1-3,5,9-12,15H,4,6-8H2,(H,24,26)(H,22,23,25)
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n/an/a 14n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189611
PNG
(CHEMBL384909 | N-benzyl-4-fluoro-3-((2-(pyridin-2-...)
Show SMILES Fc1ccc(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C23H20FN5OS/c24-19-10-9-17(22(30)27-13-16-6-2-1-3-7-16)12-20(19)26-14-18-15-28-23(31-18)29-21-8-4-5-11-25-21/h1-12,15,26H,13-14H2,(H,27,30)(H,25,28,29)
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n/an/a 17n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50168387
PNG
(2,4-Difluoro-5-[5-isopropyl-6-(5-methyl-[1,3,4]oxa...)
Show SMILES CONC(=O)c1cc(Nc2ncnn3cc(-c4nnc(C)o4)c(C(C)C)c23)c(F)cc1F
Show InChI InChI=1S/C20H19F2N7O3/c1-9(2)16-12(20-27-26-10(3)32-20)7-29-17(16)18(23-8-24-29)25-15-5-11(19(30)28-31-4)13(21)6-14(15)22/h5-9H,1-4H3,(H,28,30)(H,23,24,25)
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n/an/a 18n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a 23n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189613
PNG
(CHEMBL379370 | N-cyclopropyl-4-fluoro-3-((2-(pyrid...)
Show SMILES Fc1ccc(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H18FN5OS/c20-15-7-4-12(18(26)24-13-5-6-13)9-16(15)22-10-14-11-23-19(27-14)25-17-3-1-2-8-21-17/h1-4,7-9,11,13,22H,5-6,10H2,(H,24,26)(H,21,23,25)
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n/an/a 29n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189606
PNG
(4-fluoro-N-methyl-3-((2-(pyridin-2-ylamino)thiazol...)
Show SMILES CNC(=O)c1ccc(F)c(NCc2cnc(Nc3ccccn3)s2)c1
Show InChI InChI=1S/C17H16FN5OS/c1-19-16(24)11-5-6-13(18)14(8-11)21-9-12-10-22-17(25-12)23-15-4-2-3-7-20-15/h2-8,10,21H,9H2,1H3,(H,19,24)(H,20,22,23)
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n/an/a 30n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a 40n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50189605
PNG
(CHEMBL379495 | N-(5-((5-tert-butyloxazol-2-yl)meth...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1ncc(SCc2ncc(o2)C(C)(C)C)s1
Show InChI InChI=1S/C20H23N3O4S2/c1-20(2,3)15-9-21-16(27-15)11-28-17-10-22-19(29-17)23-18(24)12-6-7-13(25-4)14(8-12)26-5/h6-10H,11H2,1-5H3,(H,22,23,24)
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n/an/a 50n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of CDK2


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189604
PNG
(4-fluoro-3-((2-(pyridin-2-ylamino)thiazol-5-ylmeth...)
Show SMILES Fc1ccc(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NCc1ccccn1
Show InChI InChI=1S/C22H19FN6OS/c23-18-8-7-15(21(30)27-12-16-5-1-3-9-24-16)11-19(18)26-13-17-14-28-22(31-17)29-20-6-2-4-10-25-20/h1-11,14,26H,12-13H2,(H,27,30)(H,25,28,29)
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n/an/a 64n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189602
PNG
(2,4-difluoro-N-methyl-5-((2-(pyridin-2-ylamino)thi...)
Show SMILES CNC(=O)c1cc(NCc2cnc(Nc3ccccn3)s2)c(F)cc1F
Show InChI InChI=1S/C17H15F2N5OS/c1-20-16(25)11-6-14(13(19)7-12(11)18)22-8-10-9-23-17(26-10)24-15-4-2-3-5-21-15/h2-7,9,22H,8H2,1H3,(H,20,25)(H,21,23,24)
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n/an/a 71n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189608
PNG
(CHEMBL379661 | N-methoxy-3-((2-(pyridin-2-ylamino)...)
Show SMILES CONC(=O)c1cccc(CSc2cnc(Nc3ccccn3)s2)c1
Show InChI InChI=1S/C17H16N4O2S2/c1-23-21-16(22)13-6-4-5-12(9-13)11-24-15-10-19-17(25-15)20-14-7-2-3-8-18-14/h2-10H,11H2,1H3,(H,21,22)(H,18,19,20)
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n/an/a 74n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189610
PNG
(4-fluoro-N-(2-morpholinoethyl)-3-((2-(pyridin-2-yl...)
Show SMILES Fc1ccc(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C22H25FN6O2S/c23-18-5-4-16(21(30)25-7-8-29-9-11-31-12-10-29)13-19(18)26-14-17-15-27-22(32-17)28-20-3-1-2-6-24-20/h1-6,13,15,26H,7-12,14H2,(H,25,30)(H,24,27,28)
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n/an/a 85n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189607
PNG
(CHEMBL379320 | N-methyl-3-((2-(pyridin-2-ylamino)t...)
Show SMILES CNC(=O)c1cccc(CSc2cnc(Nc3ccccn3)s2)c1
Show InChI InChI=1S/C17H16N4OS2/c1-18-16(22)13-6-4-5-12(9-13)11-23-15-10-20-17(24-15)21-14-7-2-3-8-19-14/h2-10H,11H2,1H3,(H,18,22)(H,19,20,21)
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n/an/a 88n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189612
PNG
(CHEMBL208911 | N-cyclopentyl-4-fluoro-3-((2-(pyrid...)
Show SMILES Fc1ccc(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CCCC1
Show InChI InChI=1S/C21H22FN5OS/c22-17-9-8-14(20(28)26-15-5-1-2-6-15)11-18(17)24-12-16-13-25-21(29-16)27-19-7-3-4-10-23-19/h3-4,7-11,13,15,24H,1-2,5-6,12H2,(H,26,28)(H,23,25,27)
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n/an/a 110n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a 200n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PDGFR beta


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189614
PNG
(CHEMBL207520 | N-methyl-3-((2-(pyridin-2-ylamino)t...)
Show SMILES CNC(=O)c1cccc(NCc2cnc(Nc3ccccn3)s2)c1
Show InChI InChI=1S/C17H17N5OS/c1-18-16(23)12-5-4-6-13(9-12)20-10-14-11-21-17(24-14)22-15-7-2-3-8-19-15/h2-9,11,20H,10H2,1H3,(H,18,23)(H,19,21,22)
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n/an/a 280n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a 370n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of c-kit


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a 400n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50189605
PNG
(CHEMBL379495 | N-(5-((5-tert-butyloxazol-2-yl)meth...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1ncc(SCc2ncc(o2)C(C)(C)C)s1
Show InChI InChI=1S/C20H23N3O4S2/c1-20(2,3)15-9-21-16(27-15)11-28-17-10-22-19(29-17)23-18(24)12-6-7-13(25-4)14(8-12)26-5/h6-10H,11H2,1-5H3,(H,22,23,24)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FLK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of FGFR1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of AKT


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of GSK3


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
MAP kinase p38


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of p38


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of MEK


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SRPK1


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of SRPK1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of CDK2


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a 1.66E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of IGF1R


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Protein kinase C, eta


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PKCeta


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Protein kinase C (PKC)


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PKCzeta


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PKCalpha


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JAK3


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of MAPKAPK2


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Syk


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Her2


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
CaM kinase II


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of CaMK2


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ITK/TSK


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Itk


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Lck


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
PDB
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KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
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CHEMBL
PC cid
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UniChem

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Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Her1


J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%