Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostacyclin synthase' and Ligand = 'BDBM50022122'   

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
Prostacyclin synthase (Homo sapiens (Human))	BDBM50022122 (3-(3-Imidazol-1-ylmethyl-5-methoxy-indol-1-yl)-pro...) Show SMILES COc1ccc2n(CCC(O)=O)cc(Cn3ccnc3)c2c1 Show InChI InChI=1S/C16H17N3O3/c1-22-13-2-3-15-14(8-13)12(9-18-7-5-17-11-18)10-19(15)6-4-16(20)21/h2-3,5,7-8,10-11H,4,6,9H2,1H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of PGI-2 synthetase from porcine aorta				J Med Chem 29: 342-6 (1986) BindingDB Entry DOI: 10.7270/Q2W66JSZ
					More data for this Ligand-Target Pair