Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 284.3 BDBM50017915

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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))	BDBM50017915 (3-(1-Isopropyl-5-pyridin-3-ylmethyl-1H-pyrrol-2-yl...) Show SMILES CC(C)n1c(Cc2cccnc2)ccc1\C=C(\C)C(O)=O Show InChI InChI=1S/C17H20N2O2/c1-12(2)19-15(9-13(3)17(20)21)6-7-16(19)10-14-5-4-8-18-11-14/h4-9,11-12H,10H2,1-3H3,(H,20,21)/b13-9-	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description Inhibition of thromboxane A2 synthetase as reduced ADP-induced aggregation of human platelet rich plasma in the presence of pig aortal microsomes				J Med Chem 32: 890-7 (1989) BindingDB Entry DOI: 10.7270/Q26W993X
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