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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid binding protein muscle' and Monomerid = 50319699   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Fatty acid binding protein muscle


(Homo sapiens (Human))
BDBM50319699
PNG
(2-(2-oxo-2-(2-(piperidin-1-yl)benzylamino)ethylthi...)
Show SMILES OC(=O)CSCC(=O)NCc1ccccc1N1CCCCC1
Show InChI InChI=1S/C16H22N2O3S/c19-15(11-22-12-16(20)21)17-10-13-6-2-3-7-14(13)18-8-4-1-5-9-18/h2-3,6-7H,1,4-5,8-12H2,(H,17,19)(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.30E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of 8-anilino-1-naphthalene-sulfonic acid from human His-FABP3 expressed in Escherichia coli BL21 (DE3) cells after 3 mins relative to li...


Bioorg Med Chem Lett 20: 3675-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.095
BindingDB Entry DOI: 10.7270/Q2CV4HXG
More data for this
Ligand-Target Pair