Reaction Details Report a problem with these data
Target
Prostate-specific antigen
Ligand
BDBM50434147
Substrate
n/a
Meas. Tech.
ChEMBL_959198 (CHEMBL2383481)
Ki
61±n/a nM
Citation
 Kostova, MB; Rosen, DM; Chen, Y; Mease, RC; Denmeade, SR Structural optimization, biological evaluation, and application of peptidomimetic prostate specific antigen inhibitors. J Med Chem 56:4224-35 (2013) [PubMed]  Article 
Target
Name:
Prostate-specific antigen
Synonyms:
APS | Gamma-seminoprotein | KLK3 | KLK3_HUMAN | Kallikrein-3 | P-30 antigen | PSA | Prostate specific antigen | Prostate-specific antigen | Semenogelase | Seminin
Type:
PROTEIN
Mol. Mass.:
28747.53
Organism:
Homo sapiens (Human)
Description:
ChEMBL_959198
Residue:
261
Sequence:
MWVPVVFLTLSVTWIGAAPLILSRIVGGWECEKHSQPWQVLVASRGRAVCGGVLVHPQWVLTAAHCIRNKSVILLGRHSLFHPEDTGQVFQVSHSFPHPLYDMSLLKNRFLRPGDDSSHDLMLLRLSEPAELTDAVKVMDLPTQEPALGTTCYASGWGSIEPEEFLTPKKLQCVDLHVISNDVCAQVHPQKVTKFMLCAGRWTGGKSTCSGDSGGPLVCNGVLQGITSWGSEPCALPERPSLYTKVVHYRKWIKDTIVANP
  
Inhibitor
Name:
BDBM50434147
Synonyms:
CHEMBL2381661
Type:
Small organic molecule
Emp. Form.:
C37H56BN7O9
Mol. Mass.:
753.693
SMILES:
CCCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCCN)C(=O)N[C@H](Cc1ccccc1)B(O)O |r|
Structure:
Search PDB for entries with ligand similarity: