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Target
Collagenase 3
Ligand
BDBM50403951
Substrate
n/a
Meas. Tech.
ChEMBL_106465 (CHEMBL858330)
IC50
87.1±n/a nM
Citation
 Sarma, JA; Rambabu, G; Srikanth, K; Raveendra, D; Vithal, M Analogue based design of MMP-13 (Collagenase-3) inhibitors. Bioorg Med Chem Lett 12:2689-93 (2002) [PubMed]
Target
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:
MHPGVLAAFLFLSWTHCRALPLPSGGDEDDLSEEDLQFAERYLRSYYHPTNLAGILKENAASSMTERLREMQSFFGLEVTGKLDDNTLDVMKKPRCGVPDVGEYNVFPRTLKWSKMNLTYRIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDGPSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALMFPIYTYTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPDKCDPSLSLDAITSLRGETMIFKDRFFWRLHPQQVDAELFLTKSFWPELPNRIDAAYEHPSHDLIFIFRGRKFWALNGYDILEGYPKKISELGLPKEVKKISAAVHFEDTGKTLLFSGNQVWRYDDTNHIMDKDYPRLIEEDFPGIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPANSILWC
  
Inhibitor
Name:
BDBM50403951
Synonyms:
CHEMBL91254
Type:
Small organic molecule
Emp. Form.:
C23H27NO7S
Mol. Mass.:
461.528
SMILES:
COCCOCCC#CCC(NS(=O)(=O)c1ccc(cc1)-c1ccc(OC)cc1)C(O)=O
Structure:
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