BindingDB logo
myBDB logout

null

SMILES: CNC(=O)c1ccccc1Nc1nc(Nc2ccc(CN)cc2)nc2nccn12

InChI Key: InChIKey=OERMTVRXFMLUOQ-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 = 50059144   
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))		BDBM50059144
PNG
(CHEMBL3393284)
Show SMILES CNC(=O)c1ccccc1Nc1nc(Nc2ccc(CN)cc2)nc2nccn12
Show InChI InChI=1S/C20H20N8O/c1-22-17(29)15-4-2-3-5-16(15)25-20-27-18(26-19-23-10-11-28(19)20)24-14-8-6-13(12-21)7-9-14/h2-11H,12,21H2,1H3,(H,22,29)(H2,23,24,25,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Universit£ Paris Descartes

Curated by ChEMBL


Assay Description
Inhibition of FAK (unknown origin) using ULight-poly GT as substrate after 1.6 hrs by TR-FRET assay

J Med Chem 58: 237-51 (2015)


Article DOI: 10.1021/jm500784e
BindingDB Entry DOI: 10.7270/Q2B27WZC
More data for this
Ligand-Target Pair