Target
Stromelysin-1
Ligand
BDBM50305841
Substrate
n/a
Meas. Tech.
ChEMBL_605227 (CHEMBL1069307)
IC50
>100000±n/a nM
Citation
 Schnute, MEO'Brien, PMNahra, JMorris, MHoward Roark, WHanau, CERuminski, PGScholten, JAFletcher, TRHamper, BCCarroll, JNPatt, WCShieh, HSCollins, BPavlovsky, AGPalmquist, KEAston, KWHitchcock, JRogers, MDMcDonald, JJohnson, ARMunie, GEWittwer, AJMan, CFSettle, SLNemirovskiy, OVickery, LEAgawal, ADyer, RDSunyer, T Discovery of (pyridin-4-yl)-2H-tetrazole as a novel scaffold to identify highly selective matrix metalloproteinase-13 inhibitors for the treatment of osteoarthritis. Bioorg Med Chem Lett 20:576-80 (2010) [PubMed]  Article 
Target
Name:
Stromelysin-1
Synonyms:
MMP-3 | MMP3 | MMP3_HUMAN | Matrix metalloproteinase (2 and 3) | Matrix metalloproteinase 3 | Matrix metalloproteinase-3 | Matrix metalloproteinase-3 (MMP-3) | Matrix metalloproteinase-3 (MMP3) | SL-1 | STMY1 | Stromelysin 1 | Transin-1
Type:
Enzyme
Mol. Mass.:
53973.13
Organism:
Homo sapiens (Human)
Description:
P08254
Residue:
477
Sequence:
MKSLPILLLLCVAVCSAYPLDGAARGEDTSMNLVQKYLENYYDLKKDVKQFVRRKDSGPVVKKIREMQKFLGLEVTGKLDSDTLEVMRKPRCGVPDVGHFRTFPGIPKWRKTHLTYRIVNYTPDLPKDAVDSAVEKALKVWEEVTPLTFSRLYEGEADIMISFAVREHGDFYPFDGPGNVLAHAYAPGPGINGDAHFDDDEQWTKDTTGTNLFLVAAHEIGHSLGLFHSANTEALMYPLYHSLTDLTRFRLSQDDINGIQSLYGPPPDSPETPLVPTEPVPPEPGTPANCDPALSFDAVSTLRGEILIFKDRHFWRKSLRKLEPELHLISSFWPSLPSGVDAAYEVTSKDLVFIFKGNQFWAIRGNEVRAGYPRGIHTLGFPPTVRKIDAAISDKEKNKTYFFVEDKYWRFDEKRNSMEPGFPKQIAEDFPGIDSKIDAVFEEFGFFYFFTGSSQLEFDPNAKKVTHTLKSNSWLNC
  
Inhibitor
Name:
BDBM50305841
Synonyms:
CHEMBL605201 | N1,N3-bis(3-methoxybenzyl)isophthalamide
Type:
Small organic molecule
Emp. Form.:
C24H24N2O4
Mol. Mass.:
404.4584
SMILES:
COc1cccc(CNC(=O)c2cccc(c2)C(=O)NCc2cccc(OC)c2)c1
Structure:
Search PDB for entries with ligand similarity: