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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Hepatocyte growth factor receptor' and Ligand = 'BDBM50532763'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50532763
PNG
(CHEMBL4593634)
Show SMILES O=C(NCCN1CCOCC1)Nc1nc2ccc(Sc3nnc4ccc(NC5CCOCC5)nn34)cc2s1
Show InChI InChI=1S/C24H29N9O3S2/c34-22(25-7-8-32-9-13-36-14-10-32)28-23-27-18-2-1-17(15-19(18)38-23)37-24-30-29-21-4-3-20(31-33(21)24)26-16-5-11-35-12-6-16/h1-4,15-16H,5-14H2,(H,26,31)(H2,25,27,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1n/an/an/an/an/an/a



Sanofi-Aventis Germany GmbH

Curated by ChEMBL


Assay Description
Inhibition of wild type phosphorylated MET (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptide ad...


J Med Chem 59: 7066-74 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00280
BindingDB Entry DOI: 10.7270/Q2WM1HW4
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50532763
PNG
(CHEMBL4593634)
Show SMILES O=C(NCCN1CCOCC1)Nc1nc2ccc(Sc3nnc4ccc(NC5CCOCC5)nn34)cc2s1
Show InChI InChI=1S/C24H29N9O3S2/c34-22(25-7-8-32-9-13-36-14-10-32)28-23-27-18-2-1-17(15-19(18)38-23)37-24-30-29-21-4-3-20(31-33(21)24)26-16-5-11-35-12-6-16/h1-4,15-16H,5-14H2,(H,26,31)(H2,25,27,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1n/an/an/an/an/an/a



Sanofi-Aventis Germany GmbH

Curated by ChEMBL


Assay Description
Inhibition of wild type phosphorylated MET (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptide ad...


J Med Chem 59: 7066-74 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00280
BindingDB Entry DOI: 10.7270/Q2WM1HW4
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50532763
PNG
(CHEMBL4593634)
Show SMILES O=C(NCCN1CCOCC1)Nc1nc2ccc(Sc3nnc4ccc(NC5CCOCC5)nn34)cc2s1
Show InChI InChI=1S/C24H29N9O3S2/c34-22(25-7-8-32-9-13-36-14-10-32)28-23-27-18-2-1-17(15-19(18)38-23)37-24-30-29-21-4-3-20(31-33(21)24)26-16-5-11-35-12-6-16/h1-4,15-16H,5-14H2,(H,26,31)(H2,25,27,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 217n/an/an/an/an/an/a



Sanofi-Aventis Germany GmbH

Curated by ChEMBL


Assay Description
Inhibition of phosphorylated MET Y1230H mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...


J Med Chem 59: 7066-74 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00280
BindingDB Entry DOI: 10.7270/Q2WM1HW4
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50532763
PNG
(CHEMBL4593634)
Show SMILES O=C(NCCN1CCOCC1)Nc1nc2ccc(Sc3nnc4ccc(NC5CCOCC5)nn34)cc2s1
Show InChI InChI=1S/C24H29N9O3S2/c34-22(25-7-8-32-9-13-36-14-10-32)28-23-27-18-2-1-17(15-19(18)38-23)37-24-30-29-21-4-3-20(31-33(21)24)26-16-5-11-35-12-6-16/h1-4,15-16H,5-14H2,(H,26,31)(H2,25,27,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 217n/an/an/an/an/an/a



Sanofi-Aventis Germany GmbH

Curated by ChEMBL


Assay Description
Inhibition of phosphorylated MET Y1230H mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...


J Med Chem 59: 7066-74 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00280
BindingDB Entry DOI: 10.7270/Q2WM1HW4
More data for this
Ligand-Target Pair