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BDBM50334087 2-{5-Chloro-2-[1-(2-methoxy-ethyl)-5,5-dimethyl-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-8-ylamino]-pyrimidin-4-ylamino}-3-fluoro-N-methyl-benzamide::CHEMBL1644815

SMILES: CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3c(c2)N(CCOC)C(=O)CCC3(C)C)ncc1Cl

InChI Key: InChIKey=PRRFEHPXFCRKNK-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50334087   
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))
BDBM50334087
PNG
(2-{5-Chloro-2-[1-(2-methoxy-ethyl)-5,5-dimethyl-2-...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3c(c2)N(CCOC)C(=O)CCC3(C)C)ncc1Cl
Show InChI InChI=1S/C27H30ClFN6O3/c1-27(2)11-10-22(36)35(12-13-38-4)21-14-16(8-9-18(21)27)32-26-31-15-19(28)24(34-26)33-23-17(25(37)30-3)6-5-7-20(23)29/h5-9,14-15H,10-13H2,1-4H3,(H,30,37)(H2,31,32,33,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 18n/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
Insulin receptor


(Homo sapiens (Human))
BDBM50334087
PNG
(2-{5-Chloro-2-[1-(2-methoxy-ethyl)-5,5-dimethyl-2-...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3c(c2)N(CCOC)C(=O)CCC3(C)C)ncc1Cl
Show InChI InChI=1S/C27H30ClFN6O3/c1-27(2)11-10-22(36)35(12-13-38-4)21-14-16(8-9-18(21)27)32-26-31-15-19(28)24(34-26)33-23-17(25(37)30-3)6-5-7-20(23)29/h5-9,14-15H,10-13H2,1-4H3,(H,30,37)(H2,31,32,33,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 231n/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))
BDBM50334087
PNG
(2-{5-Chloro-2-[1-(2-methoxy-ethyl)-5,5-dimethyl-2-...)
Show SMILES CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3c(c2)N(CCOC)C(=O)CCC3(C)C)ncc1Cl
Show InChI InChI=1S/C27H30ClFN6O3/c1-27(2)11-10-22(36)35(12-13-38-4)21-14-16(8-9-18(21)27)32-26-31-15-19(28)24(34-26)33-23-17(25(37)30-3)6-5-7-20(23)29/h5-9,14-15H,10-13H2,1-4H3,(H,30,37)(H2,31,32,33,34)
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 85n/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