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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 = 'BDBM303916'   
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))		BDBM303916
PNG
(US10138242, Compound 2)
Show SMILES CCOC(=O)Cn1nc(C(=O)NCc2ccccc2)c2CN(Cc3c[nH]c4ccccc34)CCc12
Show InChI InChI=1S/C27H29N5O3/c1-2-35-25(33)18-32-24-12-13-31(16-20-15-28-23-11-7-6-10-21(20)23)17-22(24)26(30-32)27(34)29-14-19-8-4-3-5-9-19/h3-11,15,28H,2,12-14,16-18H2,1H3,(H,29,34)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+6n/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