Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50240176'   

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 9 (Homo sapiens (Human))	BDBM50240176 (CHEMBL4092500 | US9962398, Compound MST-145) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2cc(ccc2Cl)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H11ClN4O5S/c14-11-6-3-9(18(20)21)7-12(11)17-13(19)16-8-1-4-10(5-2-8)24(15,22)23/h1-7H,(H2,15,22,23)(H2,16,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	8.20	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 9 (Homo sapiens (Human))	BDBM50240176 (CHEMBL4092500 | US9962398, Compound MST-145) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2cc(ccc2Cl)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H11ClN4O5S/c14-11-6-3-9(18(20)21)7-12(11)17-13(19)16-8-1-4-10(5-2-8)24(15,22)23/h1-7H,(H2,15,22,23)(H2,16,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.20	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 Inhibition of human recombinant carbonic anhydrase 9 preincubated for 15 mins prior to testing measured for 10 to 100 secs by phenol red-based stoppe...				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