Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCollagenase 3
LigandBDBM50105437
Substrate/Competitorn/a
Meas. Tech.ChEBML_106603
IC50 600±n/a nM
Citation Becker, DPBarta, TEBedell, LDeCrescenzo, GFreskos, JGetman, DPHockerman, SLLi, MMehta, PMischke, BMunie, GESwearingen, CVillamil, CI alpha-Amino-beta-sulphone hydroxamates as potent MMP-13 inhibitors that spare MMP-1. Bioorg Med Chem Lett11:2719-22 (2001) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Collagenase 3
Name:Collagenase 3
Synonyms:MMP-13 | MMP13 | MMP13_HUMAN | Matrix metalloproteinase-13 | Matrix metalloproteinase-13 (MMP-13) | Matrix metalloproteinase-13 (MMP13)
Type:Enzyme
Mol. Mass.:53808.06
Organism:Homo sapiens (Human)
Description:P45452
Residue:471
Sequence:
MHPGVLAAFLFLSWTHCRALPLPSGGDEDDLSEEDLQFAERYLRSYYHPTNLAGILKENA
ASSMTERLREMQSFFGLEVTGKLDDNTLDVMKKPRCGVPDVGEYNVFPRTLKWSKMNLTY
RIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDG
PSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALM
FPIYTYTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPDKCDPSLSLDAITSLRGET
MIFKDRFFWRLHPQQVDAELFLTKSFWPELPNRIDAAYEHPSHDLIFIFRGRKFWALNGY
DILEGYPKKISELGLPKEVKKISAAVHFEDTGKTLLFSGNQVWRYDDTNHIMDKDYPRLI
EEDFPGIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPANSILWC
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50105437
n/a
NameBDBM50105437
Synonyms:CHEMBL90764 | N-Hydroxy-3-(4-phenoxy-benzenesulfonyl)-2-(toluene-4-sulfonylamino)-propionamide
TypeSmall organic molecule
Emp. Form.C22H22N2O7S2
Mol. Mass.490.549
SMILESCc1ccc(cc1)S(=O)(=O)NC(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: