Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 449.4 BDBM50084815

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)	BDBM50084815 (4-(((7-(quinolin-2-ylmethoxy)naphthalen-2-yl)metho...) Show SMILES OC(=O)c1ccc(COCc2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)cc1 Show InChI InChI=1S/C29H23NO4/c31-29(32)24-9-5-20(6-10-24)17-33-18-21-7-8-22-12-14-27(16-25(22)15-21)34-19-26-13-11-23-3-1-2-4-28(23)30-26/h1-16H,17-19H2,(H,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	7.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratorios Menarini Curated by ChEMBL					Assay Description In vitro binding affinity towards Cysteinyl leukotriene D4 receptor by using [3H]-LTD4 binding assay in guinea pig lung membranes				J Med Chem 43: 392-400 (2000) BindingDB Entry DOI: 10.7270/Q2DJ5DVX
					More data for this Ligand-Target Pair
Cysteinyl leukotriene receptor 1 (Homo sapiens (Human))	BDBM50084815 (4-(((7-(quinolin-2-ylmethoxy)naphthalen-2-yl)metho...) Show SMILES OC(=O)c1ccc(COCc2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)cc1 Show InChI InChI=1S/C29H23NO4/c31-29(32)24-9-5-20(6-10-24)17-33-18-21-7-8-22-12-14-27(16-25(22)15-21)34-19-26-13-11-23-3-1-2-4-28(23)30-26/h1-16H,17-19H2,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.30	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