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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid-binding protein, adipocyte' and Ligand = 'BDBM50538225'   
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, adipocyte


(Homo sapiens (Human))
BDBM50538225
PNG
(CHEMBL4639338)
Show SMILES Cc1cccc(Nc2ccccc2C(O)=O)c1-c1ccccc1
Show InChI InChI=1S/C20H17NO2/c1-14-8-7-13-18(19(14)15-9-3-2-4-10-15)21-17-12-6-5-11-16(17)20(22)23/h2-13,21H,1H3,(H,22,23)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
182n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of 1,8-ANS from recombinant human 6His-tagged FABP4 expressed in Escherichia coli BL21 DE3 incubated for 15 mins followed by 1,8-ANS add...


J Med Chem 63: 4090-4106 (2020)


Article DOI: 10.1021/acs.jmedchem.9b02107
BindingDB Entry DOI: 10.7270/Q2805648
More data for this
Ligand-Target Pair