BindingDB logo
myBDB logout

null

SMILES: COC(=O)c1cccc(Oc2nc[nH]c(=O)c2C2CC(C)=NN2C)c1

InChI Key: InChIKey=OUQLVXZDJINDCF-UHFFFAOYSA-N

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 3 hits for monomerid = 50348982   
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))
BDBM50348982
PNG
(CHEMBL1808220)
Show SMILES COC(=O)c1cccc(Oc2nc[nH]c(=O)c2C2CC(C)=NN2C)c1 |c:21|
Show InChI InChI=1S/C17H18N4O4/c1-10-7-13(21(2)20-10)14-15(22)18-9-19-16(14)25-12-6-4-5-11(8-12)17(23)24-3/h4-6,8-9,13H,7H2,1-3H3,(H,18,19,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of recombinant IRK using biotinylated-poly(GT) peptide as substrate after 60 mins


Bioorg Med Chem Lett 21: 4592-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.103
BindingDB Entry DOI: 10.7270/Q2N87B4V
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50348982
PNG
(CHEMBL1808220)
Show SMILES COC(=O)c1cccc(Oc2nc[nH]c(=O)c2C2CC(C)=NN2C)c1 |c:21|
Show InChI InChI=1S/C17H18N4O4/c1-10-7-13(21(2)20-10)14-15(22)18-9-19-16(14)25-12-6-4-5-11(8-12)17(23)24-3/h4-6,8-9,13H,7H2,1-3H3,(H,18,19,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of recombinant MET using biotinylated-poly(GT) peptide as substrate after 60 mins


Bioorg Med Chem Lett 21: 4592-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.103
BindingDB Entry DOI: 10.7270/Q2N87B4V
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50348982
PNG
(CHEMBL1808220)
Show SMILES COC(=O)c1cccc(Oc2nc[nH]c(=O)c2C2CC(C)=NN2C)c1 |c:21|
Show InChI InChI=1S/C17H18N4O4/c1-10-7-13(21(2)20-10)14-15(22)18-9-19-16(14)25-12-6-4-5-11(8-12)17(23)24-3/h4-6,8-9,13H,7H2,1-3H3,(H,18,19,22)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of 6xHis-tagged NPM-ALK using biotinylated-poly(GT) peptide as substrate after 60 mins


Bioorg Med Chem Lett 21: 4592-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.103
BindingDB Entry DOI: 10.7270/Q2N87B4V
More data for this
Ligand-Target Pair