Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50154333'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50154333 ((S)-1-(4-Sulfamoyl-phenylthiocarbamoyl)-pyrrolidin...) Show SMILES NS(=O)(=O)c1ccc(NC(=S)N2CCC[C@H]2C(O)=O)cc1 Show InChI InChI=1S/C12H15N3O4S2/c13-21(18,19)9-5-3-8(4-6-9)14-12(20)15-7-1-2-10(15)11(16)17/h3-6,10H,1-2,7H2,(H,14,20)(H,16,17)(H2,13,18,19)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibitory activity against human Carbonic anhydrase II				J Med Chem 47: 5224-9 (2004) Article DOI: 10.1021/jm049692i BindingDB Entry DOI: 10.7270/Q24F1RHJ
					More data for this Ligand-Target Pair				3D Structure (docked)