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BDBM50042152 CHEMBL114454::Lithium; 3-(2-{6-[3-(3-butoxy-phenyl)-3-hydroxy-propyl]-5,6-dihydro-pyridin-2-yl}-1-hydroxy-ethyl)-benzoate

SMILES: CCCCOc1cccc(c1)C(O)CCc1cccc(CC(O)c2cccc(c2)C([O-])=O)n1

InChI Key: InChIKey=MNQGSCNNNPTJIQ-UHFFFAOYSA-M

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50042152   
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))
BDBM50042152
PNG
(CHEMBL114454 | Lithium; 3-(2-{6-[3-(3-butoxy-pheny...)
Show SMILES CCCCOc1cccc(c1)C(O)CCc1cccc(CC(O)c2cccc(c2)C([O-])=O)n1
Show InChI InChI=1S/C27H31NO5/c1-2-3-15-33-24-12-5-8-20(17-24)25(29)14-13-22-10-6-11-23(28-22)18-26(30)19-7-4-9-21(16-19)27(31)32/h4-12,16-17,25-26,29-30H,2-3,13-15,18H2,1H3,(H,31,32)/p-1
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
PubMed
1.00E+3n/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