BDBM50405857 CHEMBL79340

SMILES: CN(C)Cc1ccc(cc1)C(=O)Oc1ccc2nc(sc2c1)S(N)(=O)=O

InChI Key: InChIKey=PPMQSWWSMXSHBV-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 = 50405857   

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
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50405857 (CHEMBL79340) Show SMILES CN(C)Cc1ccc(cc1)C(=O)Oc1ccc2nc(sc2c1)S(N)(=O)=O Show InChI InChI=1S/C17H17N3O4S2/c1-20(2)10-11-3-5-12(6-4-11)16(21)24-13-7-8-14-15(9-13)25-17(19-14)26(18,22)23/h3-9H,10H2,1-2H3,(H2,18,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp& Dohme Research Laboratory Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Carbonic anhydrase II				J Med Chem 32: 2486-92 (1989) BindingDB Entry DOI: 10.7270/Q27P90KQ
					More data for this Ligand-Target Pair