Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 561.6 BDBM50469814

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 (GUINEA PIG)	BDBM50469814 (CHEMBL336183) Show SMILES COc1cc(ccc1Cc1cn(C)c2ccc(cc12)C(=O)N(C)CC(C)C)C(=O)NS(=O)(=O)c1ccccc1C Show InChI InChI=1S/C31H35N3O5S/c1-20(2)18-34(5)31(36)24-13-14-27-26(16-24)25(19-33(27)4)15-22-11-12-23(17-28(22)39-6)30(35)32-40(37,38)29-10-8-7-9-21(29)3/h7-14,16-17,19-20H,15,18H2,1-6H3,(H,32,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ICI Pharmaceuticals Group Curated by ChEMBL					Assay Description Binding affinity to the leukotriene receptor (LTD4) from guinea pig lung parenchymal membranes assayed using [3H]LTD4 as radioligand				J Med Chem 36: 394-409 (1993) Article DOI: 10.1021/jm00055a011 BindingDB Entry DOI: 10.7270/Q2FX7D5T
					More data for this Ligand-Target Pair