Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50253872'   

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))	BDBM50253872 (CHEMBL4080604) Show SMILES [Na+].NS(=O)(=O)c1ccc(NC(=S)N\N=C2/C(=O)Nc3ccc(cc23)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C15H13N5O6S3/c16-28(22,23)9-3-1-8(2-4-9)17-15(27)20-19-13-11-7-10(29(24,25)26)5-6-12(11)18-14(13)21/h1-7H,(H2,16,22,23)(H2,17,20,27)(H,18,19,21)(H,24,25,26)/p-1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Istanbul University Curated by ChEMBL					Assay Description Inhibition of recombinant human membrane bound carbonic anhydrase 9 expressed in Escherichia coli pretreated for 15 mins prior to testing by stopped-...				Bioorg Med Chem 25: 3714-3718 (2017) Article DOI: 10.1016/j.bmc.2017.05.029 BindingDB Entry DOI: 10.7270/Q2Z03BMN
					More data for this Ligand-Target Pair