Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thromboxane-A synthase' and Ligand = 'BDBM50023014'   

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
Thromboxane-A synthase (Homo sapiens (Human))	BDBM50023014 (CHEMBL40983 | N-Butyl-4-[2-imidazol-1-yl-1-(4-meth...) Show SMILES CCCCN(C)C(=O)c1ccc(COC(COCc2ccc(OC)cc2)Cn2ccnc2)cc1 Show InChI InChI=1S/C27H35N3O4/c1-4-5-15-29(2)27(31)24-10-6-23(7-11-24)19-34-26(17-30-16-14-28-21-30)20-33-18-22-8-12-25(32-3)13-9-22/h6-14,16,21,26H,4-5,15,17-20H2,1-3H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for inhibitory activity against intact human platelet TXA2 formation				J Med Chem 30: 1588-95 (1987) BindingDB Entry DOI: 10.7270/Q20R9NDV
					More data for this Ligand-Target Pair