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BDBM50311899 3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2-ylamino)-N-(3-(difluoromethoxy)phenyl)-4-methylbenzamide::CHEMBL1088027

SMILES: Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1

InChI Key: InChIKey=GLDQJVYQRVZJIH-UHFFFAOYSA-N

Data: 7 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50311899   
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
Insulin receptor


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused InsR expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
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n/an/a 47n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused LCK expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase HCK


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
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n/an/a>2.50E+3n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of HCK


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
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n/an/a 92n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused KDR expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lyn


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
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n/an/a 100n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused LYN expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused SRC expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50311899
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Show InChI InChI=1S/C26H21F2N7O2/c1-15-9-10-16(24(36)32-17-5-4-6-18(12-17)37-25(27)28)11-20(15)34-26-33-19-7-2-3-8-21(19)35(26)23-13-22(29)30-14-31-23/h2-14,25H,1H3,(H,32,36)(H,33,34)(H2,29,30,31)
PDB

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n/an/a 17n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused LCK expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair