Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50240174'   

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))	BDBM50240174 (CHEMBL4100248 | US9962398, Compound MST-147) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2c(F)cccc2F)cc1 Show InChI InChI=1S/C13H11F2N3O3S/c14-10-2-1-3-11(15)12(10)18-13(19)17-8-4-6-9(7-5-8)22(16,20)21/h1-7H,(H2,16,20,21)(H2,17,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	US Patent	6.10	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))	BDBM50240174 (CHEMBL4100248 | US9962398, Compound MST-147) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2c(F)cccc2F)cc1 Show InChI InChI=1S/C13H11F2N3O3S/c14-10-2-1-3-11(15)12(10)18-13(19)17-8-4-6-9(7-5-8)22(16,20)21/h1-7H,(H2,16,20,21)(H2,17,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	6.10	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 Binding affinity was determined based on the displacement of [125]r-ANF (99-126) from binding sites onmouse fibroblasts (NIH 3T3) cells (Atrionatriur...				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