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BDBM50334089 2-[5-Chloro-2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-8-ylamino)-pyrimidin-4-ylamino]-3-fluoro-N-methyl-benzamide::CHEMBL1644809

SMILES: CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3CCCC(=O)Nc3c2)ncc1Cl

InChI Key: InChIKey=YJFOJLPHZMITIB-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50334089   
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
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50334089
PNG
(2-[5-Chloro-2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[b...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3CCCC(=O)Nc3c2)ncc1Cl
Show InChI InChI=1S/C22H20ClFN6O2/c1-25-21(32)14-5-3-6-16(24)19(14)29-20-15(23)11-26-22(30-20)27-13-9-8-12-4-2-7-18(31)28-17(12)10-13/h3,5-6,8-11H,2,4,7H2,1H3,(H,25,32)(H,28,31)(H2,26,27,29,30)
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n/an/a 99n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of c-Met phosphorylation in human GTL16 cells after 2 hrs by immunoassay


Bioorg Med Chem 19: 6274-84 (2011)


Article DOI: 10.1016/j.bmc.2011.09.006
BindingDB Entry DOI: 10.7270/Q24M950J
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50334089
PNG
(2-[5-Chloro-2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[b...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3CCCC(=O)Nc3c2)ncc1Cl
Show InChI InChI=1S/C22H20ClFN6O2/c1-25-21(32)14-5-3-6-16(24)19(14)29-20-15(23)11-26-22(30-20)27-13-9-8-12-4-2-7-18(31)28-17(12)10-13/h3,5-6,8-11H,2,4,7H2,1H3,(H,25,32)(H,28,31)(H2,26,27,29,30)
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n/an/a 30n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of c-Met phosphorylation in human GTL16 cells after 2 hrs by immunoassay


Bioorg Med Chem 19: 6274-84 (2011)


Article DOI: 10.1016/j.bmc.2011.09.006
BindingDB Entry DOI: 10.7270/Q24M950J
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50334089
PNG
(2-[5-Chloro-2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[b...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3CCCC(=O)Nc3c2)ncc1Cl
Show InChI InChI=1S/C22H20ClFN6O2/c1-25-21(32)14-5-3-6-16(24)19(14)29-20-15(23)11-26-22(30-20)27-13-9-8-12-4-2-7-18(31)28-17(12)10-13/h3,5-6,8-11H,2,4,7H2,1H3,(H,25,32)(H,28,31)(H2,26,27,29,30)
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n/an/a 369n/an/an/an/an/an/a



Cephalon, Inc

Curated by ChEMBL


Assay Description
Inhibition of IR kinase


Bioorg Med Chem Lett 21: 164-7 (2010)

Checked by Author
Article DOI: 10.1016/j.bmcl.2010.11.045
BindingDB Entry DOI: 10.7270/Q28W3F85
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50334089
PNG
(2-[5-Chloro-2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[b...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3CCCC(=O)Nc3c2)ncc1Cl
Show InChI InChI=1S/C22H20ClFN6O2/c1-25-21(32)14-5-3-6-16(24)19(14)29-20-15(23)11-26-22(30-20)27-13-9-8-12-4-2-7-18(31)28-17(12)10-13/h3,5-6,8-11H,2,4,7H2,1H3,(H,25,32)(H,28,31)(H2,26,27,29,30)
PDB
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KEGG

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PubMed
n/an/a 99n/an/an/an/an/an/a



Cephalon, Inc

Curated by ChEMBL


Assay Description
Inhibition of human c-Met in human GTL16 cells by cell-based assay


Bioorg Med Chem Lett 21: 164-7 (2010)

Checked by Author
Article DOI: 10.1016/j.bmcl.2010.11.045
BindingDB Entry DOI: 10.7270/Q28W3F85
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50334089
PNG
(2-[5-Chloro-2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[b...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3CCCC(=O)Nc3c2)ncc1Cl
Show InChI InChI=1S/C22H20ClFN6O2/c1-25-21(32)14-5-3-6-16(24)19(14)29-20-15(23)11-26-22(30-20)27-13-9-8-12-4-2-7-18(31)28-17(12)10-13/h3,5-6,8-11H,2,4,7H2,1H3,(H,25,32)(H,28,31)(H2,26,27,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Cephalon, Inc

Curated by ChEMBL


Assay Description
Inhibition of c-Met


Bioorg Med Chem Lett 21: 164-7 (2010)

Checked by Author
Article DOI: 10.1016/j.bmcl.2010.11.045
BindingDB Entry DOI: 10.7270/Q28W3F85
More data for this
Ligand-Target Pair