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BDBM50221346 4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-methoxy-naphthalen-2-yl)-1-methyl-3H-imidazol-4-yl]-pyridine::CHEMBL237570

SMILES: COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1

InChI Key: InChIKey=BARYYLFEOIUPEY-UHFFFAOYSA-N

Data: 16 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 16 hits for monomerid = 50221346   
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))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of INSR


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of IGFR1


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of KIT


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Angiopoietin-1 receptor


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a 12n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of Tie2


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of FLT3


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Macrophage colony stimulating factor receptor


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a 550n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of cFMS


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of Abl kinase


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a 9.70E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of FGFR1


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of AKT1


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of PKCbeta1


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of MET


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50221346
PNG
(4-[2-(4-methanesulfinyl-2-methyl-phenyl)-5-(6-meth...)
Show SMILES COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
Show InChI InChI=1S/C28H25N3O2S/c1-18-15-24(34(4)32)9-10-25(18)28-30-26(19-11-13-29-14-12-19)27(31(28)2)22-6-5-21-17-23(33-3)8-7-20(21)16-22/h5-17H,1-4H3
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n/an/a 296n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of ALK5


Bioorg Med Chem Lett 17: 5514-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.052
BindingDB Entry DOI: 10.7270/Q2542N96
More data for this
Ligand-Target Pair