BDBM50430300 CHEMBL2333432

SMILES: CN1c2ccc(cc2-c2n[nH]cc2S1(=O)=O)-c1ccc(cc1)C(N)=O

InChI Key: InChIKey=PXRULJZQXIUNTM-UHFFFAOYSA-N

Data: 1 IC50

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 = 50430300   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM50430300 (CHEMBL2333432) Show SMILES CN1c2ccc(cc2-c2n[nH]cc2S1(=O)=O)-c1ccc(cc1)C(N)=O Show InChI InChI=1S/C17H14N4O3S/c1-21-14-7-6-12(10-2-4-11(5-3-10)17(18)22)8-13(14)16-15(9-19-20-16)25(21,23)24/h2-9H,1H3,(H2,18,22)(H,19,20)	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/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Ltd Curated by ChEMBL					Assay Description Allosteric inhibition of FAK (unknown origin) using poly-(GT)-biotin and 0.5 uM of ATP preincubated for 60 mins measured after 1 hr by HTRF assay				Bioorg Med Chem Lett 23: 1779-85 (2013) Article DOI: 10.1016/j.bmcl.2013.01.047 BindingDB Entry DOI: 10.7270/Q26Q1ZK9
					More data for this Ligand-Target Pair