Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thromboxane-A synthase' and Ligand = 'BDBM50022998'   

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))	BDBM50022998 (1-[3-(4-Methoxy-benzyloxy)-2-(4-methylsulfanyl-ben...) Show SMILES COc1ccc(COCC(Cn2ccnc2)OCc2ccc(SC)cc2)cc1 Show InChI InChI=1S/C22H26N2O3S/c1-25-20-7-3-18(4-8-20)14-26-16-21(13-24-12-11-23-17-24)27-15-19-5-9-22(28-2)10-6-19/h3-12,17,21H,13-16H2,1-2H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.40E+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