Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 377.4 BDBM50013535

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

Found 2 hits 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)	BDBM50013535 (2-{4-[3-(1H-Tetrazol-5-yl)-propylsulfanyl]-phenoxy...) Show SMILES C(CSc1ccc(OCc2ccc3ccccc3n2)cc1)Cc1nnn[nH]1 Show InChI InChI=1S/C20H19N5OS/c1-2-5-19-15(4-1)7-8-16(21-19)14-26-17-9-11-18(12-10-17)27-13-3-6-20-22-24-25-23-20/h1-2,4-5,7-12H,3,6,13-14H2,(H,22,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rorer Central Research Curated by ChEMBL					Assay Description Binding affinity against Cysteinyl leukotriene D4 receptor from guinea pig lung was determined using [3H]-LTD4 (0.2 nM)				J Med Chem 33: 1186-94 (1990) BindingDB Entry DOI: 10.7270/Q2TB15WM
					More data for this Ligand-Target Pair
Cysteinyl leukotriene receptor 1/2 (Homo sapiens (Human))	BDBM50013535 (2-{4-[3-(1H-Tetrazol-5-yl)-propylsulfanyl]-phenoxy...) Show SMILES C(CSc1ccc(OCc2ccc3ccccc3n2)cc1)Cc1nnn[nH]1 Show InChI InChI=1S/C20H19N5OS/c1-2-5-19-15(4-1)7-8-16(21-19)14-26-17-9-11-18(12-10-17)27-13-3-6-20-22-24-25-23-20/h1-2,4-5,7-12H,3,6,13-14H2,(H,22,23,24,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Rorer Central Research Curated by ChEMBL					Assay Description Inhibition of the spasmogenic activity of LTD4 in guinea pig parenchymal strips.				J Med Chem 33: 1186-94 (1990) BindingDB Entry DOI: 10.7270/Q2TB15WM
					More data for this Ligand-Target Pair