BDBM50367994 CHEMBL1203519

SMILES: NC(NCc1ccccc1)=Nc1nc(cs1)-c1c[nH]c2ccc(Br)cc12

InChI Key: InChIKey=RGFAOEOUXAPQKQ-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 = 50367994   

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
Potassium-transporting ATPase alpha chain 1/beta chain (Homo sapiens (Human))	BDBM50367994 (CHEMBL1203519) Show SMILES NC(NCc1ccccc1)=Nc1nc(cs1)-c1c[nH]c2ccc(Br)cc12 |w:10.11| Show InChI InChI=1S/C19H16BrN5S/c20-13-6-7-16-14(8-13)15(10-22-16)17-11-26-19(24-17)25-18(21)23-9-12-4-2-1-3-5-12/h1-8,10-11,22H,9H2,(H3,21,23,24,25)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibitory activity against dog gastric proton-pump enzyme H+/K+ ATPase				J Med Chem 33: 543-52 (1990) BindingDB Entry DOI: 10.7270/Q2K35V79
					More data for this Ligand-Target Pair