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6 similar compounds to monomer 50131114

Wt: 423.9
BDBM13356
Wt: 468.9
BDBM50131117
Wt: 509.0
BDBM50131134
Wt: 409.8
BDBM50131139
Wt: 454.9
BDBM50131142
Wt: 497.0
BDBM50131152

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 13356,50131117,50131134,50131139,50131142,50131152   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
SRC


(Homo sapiens (human))
BDBM13356
PNG
(CHEMBL84624 | N-(2-chloro-6-methylphenyl)-2-[(2,6-...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(C)n1
Show InChI InChI=1S/C21H18ClN5OS/c1-11-5-4-6-15(22)19(11)27-20(28)14-7-8-16-17(10-14)29-21(25-16)26-18-9-12(2)23-13(3)24-18/h4-10H,1-3H3,(H,27,28)(H,23,24,25,26)
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Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Bristol-Myers Squibb Company



Assay Description
IC50 is the inhibitor concentration, which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-33P] lab...


J Med Chem 49: 6819-32 (2006)

More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM50131117
PNG
(2-[2-(2-Hydroxy-ethylamino)-6-methyl-pyrimidin-4-y...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCCO)n1
Show InChI InChI=1S/C22H21ClN6O2S/c1-12-4-3-5-15(23)19(12)29-20(31)14-6-7-16-17(11-14)32-22(26-16)28-18-10-13(2)25-21(27-18)24-8-9-30/h3-7,10-11,30H,8-9H2,1-2H3,(H,29,31)(H2,24,25,26,27,28)
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n/an/a 1.10n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50131117
PNG
(2-[2-(2-Hydroxy-ethylamino)-6-methyl-pyrimidin-4-y...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCCO)n1
Show InChI InChI=1S/C22H21ClN6O2S/c1-12-4-3-5-15(23)19(12)29-20(31)14-6-7-16-17(11-14)32-22(26-16)28-18-10-13(2)25-21(27-18)24-8-9-30/h3-7,10-11,30H,8-9H2,1-2H3,(H,29,31)(H2,24,25,26,27,28)
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n/an/a 10n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Src protein tryrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM13356
PNG
(CHEMBL84624 | N-(2-chloro-6-methylphenyl)-2-[(2,6-...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(C)n1
Show InChI InChI=1S/C21H18ClN5OS/c1-11-5-4-6-15(22)19(11)27-20(28)14-7-8-16-17(10-14)29-21(25-16)26-18-9-12(2)23-13(3)24-18/h4-10H,1-3H3,(H,27,28)(H,23,24,25,26)
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n/an/a 20n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM50131117
PNG
(2-[2-(2-Hydroxy-ethylamino)-6-methyl-pyrimidin-4-y...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCCO)n1
Show InChI InChI=1S/C22H21ClN6O2S/c1-12-4-3-5-15(23)19(12)29-20(31)14-6-7-16-17(11-14)32-22(26-16)28-18-10-13(2)25-21(27-18)24-8-9-30/h3-7,10-11,30H,8-9H2,1-2H3,(H,29,31)(H2,24,25,26,27,28)
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n/an/a 2n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM50131139
PNG
(2-(6-Methyl-pyrimidin-4-ylamino)-benzothiazole-6-c...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)ncn1
Show InChI InChI=1S/C20H16ClN5OS/c1-11-4-3-5-14(21)18(11)26-19(27)13-6-7-15-16(9-13)28-20(24-15)25-17-8-12(2)22-10-23-17/h3-10H,1-2H3,(H,26,27)(H,22,23,24,25)
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n/an/a 21n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM50131142
PNG
(2-[2-(2-Hydroxy-ethylamino)-pyrimidin-4-ylamino]-b...)
Show SMILES Cc1cccc(Cl)c1NC(=O)c1ccc2nc(Nc3ccnc(NCCO)n3)sc2c1
Show InChI InChI=1S/C21H19ClN6O2S/c1-12-3-2-4-14(22)18(12)28-19(30)13-5-6-15-16(11-13)31-21(25-15)27-17-7-8-23-20(26-17)24-9-10-29/h2-8,11,29H,9-10H2,1H3,(H,28,30)(H2,23,24,25,26,27)
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n/an/a 3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (Human))
BDBM50131117
PNG
(2-[2-(2-Hydroxy-ethylamino)-6-methyl-pyrimidin-4-y...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCCO)n1
Show InChI InChI=1S/C22H21ClN6O2S/c1-12-4-3-5-15(23)19(12)29-20(31)14-6-7-16-17(11-14)32-22(26-16)28-18-10-13(2)25-21(27-18)24-8-9-30/h3-7,10-11,30H,8-9H2,1-2H3,(H,29,31)(H2,24,25,26,27,28)
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n/an/a 4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Fyn protein kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM50131152
PNG
(2-[2-(2-Hydroxy-2-methyl-propylamino)-6-methyl-pyr...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCC(C)(C)O)n1
Show InChI InChI=1S/C24H25ClN6O2S/c1-13-6-5-7-16(25)20(13)31-21(32)15-8-9-17-18(11-15)34-23(28-17)30-19-10-14(2)27-22(29-19)26-12-24(3,4)33/h5-11,33H,12H2,1-4H3,(H,31,32)(H2,26,27,28,29,30)
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n/an/a 6n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (human))
BDBM50131134
PNG
(2-(6-Methyl-2-morpholin-4-ylmethyl-pyrimidin-4-yla...)
Show SMILES Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(CN2CCOCC2)n1
Show InChI InChI=1S/C25H25ClN6O2S/c1-15-4-3-5-18(26)23(15)31-24(33)17-6-7-19-20(13-17)35-25(28-19)30-21-12-16(2)27-22(29-21)14-32-8-10-34-11-9-32/h3-7,12-13H,8-11,14H2,1-2H3,(H,31,33)(H,27,28,29,30)
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n/an/a 10n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human p56 Lck tyrosine kinase


Citation and Details
More data for this
Ligand-Target Pair