Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50125584'   

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))	BDBM50125584 (CHEMBL3623663) Show SMILES O=c1ccc2ccc(OCc3cn(nn3)-c3ccccc3)cc2o1 Show InChI InChI=1S/C18H13N3O3/c22-18-9-7-13-6-8-16(10-17(13)24-18)23-12-14-11-21(20-19-14)15-4-2-1-3-5-15/h1-11H,12H2	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	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 carbonic anhydrase 9 catalytic domain by Stopped-Flow CO2 Hydrase assay				J Med Chem 59: 462-73 (2016) Article DOI: 10.1021/acs.jmedchem.5b01720 BindingDB Entry DOI: 10.7270/Q2P2710K
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50125584 (CHEMBL3623663) Show SMILES O=c1ccc2ccc(OCc3cn(nn3)-c3ccccc3)cc2o1 Show InChI InChI=1S/C18H13N3O3/c22-18-9-7-13-6-8-16(10-17(13)24-18)23-12-14-11-21(20-19-14)15-4-2-1-3-5-15/h1-11H,12H2	PDB MMDB NCI pathway 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
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9 incubated for 6 hrs by stopped flow carbon-di-oxide hydrase assay				Bioorg Med Chem 23: 6955-66 (2015) Article DOI: 10.1016/j.bmc.2015.09.041 BindingDB Entry DOI: 10.7270/Q2X63PRB
					More data for this Ligand-Target Pair