Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 525.0 BDBM50070402

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))	BDBM50070402 ((E)-6-[6-(4-Chloro-benzenesulfonylamino)-3-pyridin...) Show SMILES OC(=O)CCC\C=C\c1cc(Cc2cccnc2)cc2CC(CCc12)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C28H29ClN2O4S/c29-24-8-11-26(12-9-24)36(34,35)31-25-10-13-27-22(6-2-1-3-7-28(32)33)16-21(17-23(27)18-25)15-20-5-4-14-30-19-20/h2,4-6,8-9,11-12,14,16-17,19,25,31H,1,3,7,10,13,15,18H2,(H,32,33)/b6-2+	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherches de Croissy Curated by ChEMBL					Assay Description Anti-synthetase activity against TXA2 synthase in human whole blood assay				Bioorg Med Chem Lett 8: 1381-6 (1999) BindingDB Entry DOI: 10.7270/Q2XG9Q8H
					More data for this Ligand-Target Pair