Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 1' and Ligand = 'BDBM50500024'   

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 1 (Homo sapiens (Human))	BDBM50500024 (CHEMBL3740966) Show SMILES COc1cc(NC(=O)c2ccc3C(=O)OC(=O)c3c2)c(cc1OC)C(O)=O Show InChI InChI=1S/C18H13NO8/c1-25-13-6-11(16(21)22)12(7-14(13)26-2)19-15(20)8-3-4-9-10(5-8)18(24)27-17(9)23/h3-7H,1-2H3,(H,19,20)(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.37E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
King Saud University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 dehydration assay				Bioorg Med Chem 24: 20-5 (2016) Article DOI: 10.1016/j.bmc.2015.11.034 BindingDB Entry DOI: 10.7270/Q29K4F79
					More data for this Ligand-Target Pair