BDBM50041346 3-[2-Methoxy-4-(toluene-2-sulfonylaminocarbonyl)-benzyl]-1-methyl-1H-indole-5-carboxylic acid (4,4,4-trifluoro-3-methyl-butyl)-amide::CHEMBL26284

SMILES: COc1cc(ccc1Cc1cn(C)c2ccc(cc12)C(=O)NCCC(C)C(F)(F)F)C(=O)NS(=O)(=O)c1ccccc1C

InChI Key: InChIKey=AVKAERHBWMNDMN-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50041346   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cysteinyl leukotriene receptor 1 (GUINEA PIG)	BDBM50041346 (3-[2-Methoxy-4-(toluene-2-sulfonylaminocarbonyl)-b...) Show SMILES COc1cc(ccc1Cc1cn(C)c2ccc(cc12)C(=O)NCCC(C)C(F)(F)F)C(=O)NS(=O)(=O)c1ccccc1C Show InChI InChI=1S/C31H32F3N3O5S/c1-19-7-5-6-8-28(19)43(40,41)36-30(39)23-10-9-21(27(17-23)42-4)15-24-18-37(3)26-12-11-22(16-25(24)26)29(38)35-14-13-20(2)31(32,33)34/h5-12,16-18,20H,13-15H2,1-4H3,(H,35,38)(H,36,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ZENECA Pharmaceuticals Group Curated by ChEMBL					Assay Description Inhibition constant for displacement of [3H]-LTD4 on guinea pig lung parenchymal membranes				J Med Chem 37: 1282-97 (1994) BindingDB Entry DOI: 10.7270/Q2SN0812
					More data for this Ligand-Target Pair