Reaction Details Report a problem with these data
Target
Protoporphyrinogen oxidase
Ligand
BDBM50487199
Substrate
n/a
Meas. Tech.
ChEMBL_908776 (CHEMBL3066844)
Ki
690±n/a nM
Citation
 Zhang, L; Tan, Y; Wang, NX; Wu, QY; Xi, Z; Yang, GF Design, syntheses and 3D-QSAR studies of novel N-phenyl pyrrolidin-2-ones and N-phenyl-1H-pyrrol-2-ones as protoporphyrinogen oxidase inhibitors. Bioorg Med Chem 18:7948-56 (2010) [PubMed]  Article 
Target
Name:
Protoporphyrinogen oxidase
Synonyms:
PPO | PPOX | PPOX_HUMAN
Type:
PROTEIN
Mol. Mass.:
50774.78
Organism:
Homo sapiens (Human)
Description:
ChEMBL_791250
Residue:
477
Sequence:
MGRTVVVLGGGISGLAASYHLSRAPCPPKVVLVESSERLGGWIRSVRGPNGAIFELGPRGIRPAGALGARTLLLVSELGLDSEVLPVRGDHPAAQNRFLYVGGALHALPTGLRGLLRPSPPFSKPLFWAGLRELTKPRGKEPDETVHSFAQRRLGPEVASLAMDSLCRGVFAGNSRELSIRSCFPSLFQAEQTHRSILLGLLLGAGRTPQPDSALIRQALAERWSQWSLRGGLEMLPQALETHLTSRGVSVLRGQPVCGLSLQAEGRWKVSLRDSSLEADHVISAIPASVLSELLPAEAAPLARALSAITAVSVAVVNLQYQGAHLPVQGFGHLVPSSEDPGVLGIVYDSVAFPEQDGSPPGLRVTVMLGGSWLQTLEASGCVLSQELFQQRAQEAAATQLGLKEMPSHCLVHLHKNCIPQYTLGHWQKLESARQFLTAHRLPLTLAGASYEGVAVNDCIESGRQAAVSVLGTEPNS
  
Inhibitor
Name:
BDBM50487199
Synonyms:
CHEMBL2252347
Type:
Small organic molecule
Emp. Form.:
C17H19ClFNO2
Mol. Mass.:
323.79
SMILES:
CC(C)Oc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9|
Structure:
Search PDB for entries with ligand similarity: