Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 1' and Ligand = 'BDBM50240191'   

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 1 (Homo sapiens (Human))	BDBM50240191 (CHEMBL1569032 | US9962398, Compound MST-143) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1 Show InChI InChI=1S/C13H12ClN3O3S/c14-9-2-1-3-11(8-9)17-13(18)16-10-4-6-12(7-5-10)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	US Patent	158	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Washington at Seattle					Assay Description CA INHIBITION DATA WITH UREIDOSUBSTITUTED SULFONAMIDES				J Med Chem 52: 1864-72 (2009) BindingDB Entry DOI: 10.7270/Q2Q242KS
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50240191 (CHEMBL1569032 | US9962398, Compound MST-143) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1 Show InChI InChI=1S/C13H12ClN3O3S/c14-9-2-1-3-11(8-9)17-13(18)16-10-4-6-12(7-5-10)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	158	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against dog gastric proton-pump enzyme H+/K+ ATPase				Bioorg Med Chem 25: 2569-2576 (2017) Article DOI: 10.1016/j.bmc.2017.03.027 BindingDB Entry DOI: 10.7270/Q22F7QKP
					More data for this Ligand-Target Pair