Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 475.4 BDBM50057218

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 (Homo sapiens (Human))	BDBM50057218 ((E)-1-[2-Hydroxy-5-(1H-tetrazol-5-ylmethoxy)-pheny...) Show SMILES Oc1ccc(OCc2nnn[nH]2)cc1C(=O)C=Cc1cccc(C=Cc2ccc3ccccc3n2)c1 |w:24.26,17.19| Show InChI InChI=1S/C28H21N5O3/c34-26(24-17-23(13-15-27(24)35)36-18-28-30-32-33-31-28)14-9-20-5-3-4-19(16-20)8-11-22-12-10-21-6-1-2-7-25(21)29-22/h1-17,35H,18H2,(H,30,31,32,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Antagonist activity at CysLT1 receptor in human dU937 cells assessed as inhibition of LTD4-induced increase of calcium level treated 30 mins before L...				Bioorg Med Chem 18: 5519-27 (2010) Article DOI: 10.1016/j.bmc.2010.06.047 BindingDB Entry DOI: 10.7270/Q26D5TZ0
					More data for this Ligand-Target Pair
Cysteinyl leukotriene receptor 1/2 (Homo sapiens (Human))	BDBM50057218 ((E)-1-[2-Hydroxy-5-(1H-tetrazol-5-ylmethoxy)-pheny...) Show SMILES Oc1ccc(OCc2nnn[nH]2)cc1C(=O)C=Cc1cccc(C=Cc2ccc3ccccc3n2)c1 |w:24.26,17.19| Show InChI InChI=1S/C28H21N5O3/c34-26(24-17-23(13-15-27(24)35)36-18-28-30-32-33-31-28)14-9-20-5-3-4-19(16-20)8-11-22-12-10-21-6-1-2-7-25(21)29-22/h1-17,35H,18H2,(H,30,31,32,33)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Curated by ChEMBL					Assay Description Displacement of [3H]LTD4 from Cysteinyl leukotriene D4 receptor in guinea pig lung membranes				J Med Chem 40: 1075-89 (1997) Article DOI: 10.1021/jm960628d BindingDB Entry DOI: 10.7270/Q25141XJ
					More data for this Ligand-Target Pair