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BDBM50042151 CHEMBL115826::Lithium; 3-[7-(1-hydroxy-nonyl)-naphthalen-2-ylmethanesulfinyl]-benzoate

SMILES: CCCCCCCCC(O)c1ccc2ccc(CS(=O)c3cccc(c3)C([O-])=O)cc2c1

InChI Key: InChIKey=RQBONLARAWKKIT-UHFFFAOYSA-M

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50042151   
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
LTB4R


(Homo sapiens (Human))
BDBM50042151
PNG
(CHEMBL115826 | Lithium; 3-[7-(1-hydroxy-nonyl)-nap...)
Show SMILES CCCCCCCCC(O)c1ccc2ccc(CS(=O)c3cccc(c3)C([O-])=O)cc2c1
Show InChI InChI=1S/C27H32O4S/c1-2-3-4-5-6-7-11-26(28)22-15-14-21-13-12-20(16-24(21)17-22)19-32(31)25-10-8-9-23(18-25)27(29)30/h8-10,12-18,26,28H,2-7,11,19H2,1H3,(H,29,30)/p-1
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
PubMed
500n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of [3H]- LTB4 binding on human whole cells


J Med Chem 36: 3308-20 (1993)


BindingDB Entry DOI: 10.7270/Q21R6R4P
More data for this
Ligand-Target Pair