BindingDB logo
myBDB logout

null

SMILES: COc1cc(Nc2ncc3ccn(-c4ccccc4CO)c3n2)cc(OC)c1OC

InChI Key: InChIKey=AERDKMXMONKWTK-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 1 hit for monomerid = 50184016   
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
Focal adhesion kinase 1


(Homo sapiens (Human))		BDBM50184016
PNG
((2-(2-(3,4,5-trimethoxyphenylamino)-7H-pyrrolo[2,3...)
Show SMILES COc1cc(Nc2ncc3ccn(-c4ccccc4CO)c3n2)cc(OC)c1OC
Show InChI InChI=1S/C22H22N4O4/c1-28-18-10-16(11-19(29-2)20(18)30-3)24-22-23-12-14-8-9-26(21(14)25-22)17-7-5-4-6-15(17)13-27/h4-12,27H,13H2,1-3H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
Article
PubMed
n/an/a 727n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of FAK

Bioorg Med Chem Lett 16: 2689-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.02.032
BindingDB Entry DOI: 10.7270/Q2NK3DN0
More data for this
Ligand-Target Pair