Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50167349'   

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))	BDBM50167349 (4-[2-(4,6-Bis-dimethylamino-[1,3,5]triazin-2-ylami...) Show SMILES CN(C)c1nc(NCCc2ccc(cc2)S(N)(=O)=O)nc(n1)N(C)C Show InChI InChI=1S/C15H23N7O2S/c1-21(2)14-18-13(19-15(20-14)22(3)4)17-10-9-11-5-7-12(8-6-11)25(16,23)24/h5-8H,9-10H2,1-4H3,(H2,16,23,24)(H,17,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.5	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 constant against human Carbonic anhydrase IX				Bioorg Med Chem Lett 15: 3102-8 (2005) Article DOI: 10.1016/j.bmcl.2005.04.056 BindingDB Entry DOI: 10.7270/Q2NP256X
					More data for this Ligand-Target Pair