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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisomal membrane protein PEX14' and Ligand = 'BDBM303956'   
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
Peroxisomal membrane protein PEX14


(Homo sapiens (Human))		BDBM303956
PNG
(US10138242, Compound 42)
Show SMILES OCCn1nc(C(=O)NCc2cccc3ccccc23)c2CN(Cc3ccc(Cl)cc3)CCc12
Show InChI InChI=1S/C27H27ClN4O2/c28-22-10-8-19(9-11-22)17-31-13-12-25-24(18-31)26(30-32(25)14-15-33)27(34)29-16-21-6-3-5-20-4-1-2-7-23(20)21/h1-11,33H,12-18H2,(H,29,34)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 8.61E+4n/an/an/an/a



Technische Universit£t M£nchen

Curated by ChEMBL


Assay Description
Inhibition of biotinylated PEX5-derived ALSENWAQEFLA binding to human N-terminal His-tagged PEX14 (21 to 84 residues) expressed in Escherichia coli B...

J Med Chem 63: 847-879 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01876
BindingDB Entry DOI: 10.7270/Q20G3PJ1
More data for this
Ligand-Target Pair