Reaction Details Report a problem with these data
Target
Matrilysin
Ligand
BDBM50433879
Substrate
n/a
Meas. Tech.
ChEMBL_959635 (CHEMBL2382705)
Ki
50±n/a nM
Citation
 Jin, Y; Roycik, MD; Bosco, DB; Cao, Q; Constantino, MH; Schwartz, MA; Sang, QX Matrix metalloproteinase inhibitors based on the 3-mercaptopyrrolidine core. J Med Chem 56:4357-73 (2013) [PubMed]  Article 
Target
Name:
Matrilysin
Synonyms:
MMP7 | MMP7_HUMAN | MPSL1 | Matrix metalloproteinase 7 | Matrix metalloproteinase-7 (MMP-7) | Matrix metalloproteinase-7 (MMP7) | PUMP1
Type:
Enzyme
Mol. Mass.:
29681.54
Organism:
Homo sapiens (Human)
Description:
P09237
Residue:
267
Sequence:
MRLTVLCAVCLLPGSLALPLPQEAGGMSELQWEQAQDYLKRFYLYDSETKNANSLEAKLKEMQKFFGLPITGMLNSRVIEIMQKPRCGVPDVAEYSLFPNSPKWTSKVVTYRIVSYTRDLPHITVDRLVSKALNMWGKEIPLHFRKVVWGTADIMIGFARGAHGDSYPFDGPGNTLAHAFAPGTGLGGDAHFDEDERWTDGSSLGINFLYAATHELGHSLGMGHSSDPNAVMYPTYGNGDPQNFKLSQDDIKGIQKLYGKRSNSRKK
  
Inhibitor
Name:
BDBM50433879
Synonyms:
CHEMBL2380388
Type:
Small organic molecule
Emp. Form.:
C30H36N4O5S2
Mol. Mass.:
596.761
SMILES:
CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)S[C@H]1CN(C[C@H]1S)C(=O)CN1C(=O)c2ccccc2C1=O |r|
Structure:
Search PDB for entries with ligand similarity: