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BDBM50041360 3-[2-Methoxy-4-(toluene-2-sulfonylaminocarbonyl)-benzyl]-1-methyl-1H-indole-5-carboxylic acid (4,4,4-trifluoro-2,2-dimethyl-butyl)-amide::CHEMBL26384

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

InChI Key: InChIKey=HOSBGERYPOEJKH-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50041360   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cysteinyl leukotriene receptor 1


(GUINEA PIG)
BDBM50041360
PNG
(3-[2-Methoxy-4-(toluene-2-sulfonylaminocarbonyl)-b...)
Show SMILES COc1cc(ccc1Cc1cn(C)c2ccc(cc12)C(=O)NCC(C)(C)CC(F)(F)F)C(=O)NS(=O)(=O)c1ccccc1C
Show InChI InChI=1S/C32H34F3N3O5S/c1-20-8-6-7-9-28(20)44(41,42)37-30(40)23-11-10-21(27(16-23)43-5)14-24-17-38(4)26-13-12-22(15-25(24)26)29(39)36-19-31(2,3)18-32(33,34)35/h6-13,15-17H,14,18-19H2,1-5H3,(H,36,39)(H,37,40)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.20n/an/an/an/an/an/an/an/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