Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 647.4 BDBM50285681

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
Cysteinyl leukotriene receptor 1 (Homo sapiens (Human))	BDBM50285681 (CHEMBL82790 | [1-((R)-3-(4-Bromo-phenyl)-1-{3-[(E)...) Show SMILES OC(=O)CC1(CS[C@H](CCc2ccc(Br)cc2)c2cccc(\C=C\c3ccc4sc(Cl)c(Cl)c4n3)c2)CC1 Show InChI InChI=1S/C30H26BrCl2NO2S2/c31-22-8-4-19(5-9-22)7-12-24(37-18-30(14-15-30)17-26(35)36)21-3-1-2-20(16-21)6-10-23-11-13-25-28(34-23)27(32)29(33)38-25/h1-6,8-11,13,16,24H,7,12,14-15,17-18H2,(H,35,36)/b10-6+/t24-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of binding of [ H]-LTD4 to DMSO differentiated U937 cell membranes				Bioorg Med Chem Lett 5: 2551-2556 (1995) Article DOI: 10.1016/0960-894X(95)00448-3 BindingDB Entry DOI: 10.7270/Q2W37W8Q
					More data for this Ligand-Target Pair