BDBM50347734 CHEMBL1802767

SMILES: OC(=O)\C=C\c1cccc(Oc2cnc3ccccc3n2)c1

InChI Key: InChIKey=AWCDTZZQMFUUBK-CMDGGOBGSA-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 = 50347734   

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
Transforming protein RhoA (Homo sapiens (Human))	BDBM50347734 (CHEMBL1802767) Show SMILES OC(=O)\C=C\c1cccc(Oc2cnc3ccccc3n2)c1 Show InChI InChI=1S/C17H12N2O3/c20-17(21)9-8-12-4-3-5-13(10-12)22-16-11-18-14-6-1-2-7-15(14)19-16/h1-11H,(H,20,21)/b9-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
East China University of Science and Technology Curated by ChEMBL					Assay Description Inhibition of rhoA expressed in Escherichia coli BL21 after 1 hr by G-LISA activation based chemiluminiscence assay				J Med Chem 54: 4508-22 (2011) Article DOI: 10.1021/jm200161c BindingDB Entry DOI: 10.7270/Q2C53M61
					More data for this Ligand-Target Pair