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Target
Collagenase 3
Ligand
BDBM50171541
Substrate
n/a
Meas. Tech.
ChEMBL_321254 (CHEMBL880932)
IC50
11±n/a nM
Citation
 Levin, JI; Chen, JM; Laakso, LM; Du, M; Du, X; Venkatesan, AM; Sandanayaka, V; Zask, A; Xu, J; Xu, W; Zhang, Y; Skotnicki, JS Acetylenic TACE inhibitors. Part 2: SAR of six-membered cyclic sulfonamide hydroxamates. Bioorg Med Chem Lett 15:4345-9 (2005) [PubMed]  Article 
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:
Human
Description:
P45452
Residue:
471
Sequence:
MHPGVLAAFLFLSWTHCRALPLPSGGDEDDLSEEDLQFAERYLRSYYHPTNLAGILKENAASSMTERLREMQSFFGLEVTGKLDDNTLDVMKKPRCGVPDVGEYNVFPRTLKWSKMNLTYRIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDGPSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALMFPIYTYTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPDKCDPSLSLDAITSLRGETMIFKDRFFWRLHPQQVDAELFLTKSFWPELPNRIDAAYEHPSHDLIFIFRGRKFWALNGYDILEGYPKKISELGLPKEVKKISAAVHFEDTGKTLLFSGNQVWRYDDTNHIMDKDYPRLIEEDFPGIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPANSILWC
  
Inhibitor
Name:
BDBM50171541
Synonyms:
9-(4-But-2-ynyloxy-benzenesulfonyl)-6-thia-9-aza-spiro[4.5]decane-10-carboxylic acid hydroxyamide | CHEMBL434187
Type:
Small organic molecule
Emp. Form.:
C19H24N2O5S2
Mol. Mass.:
424.534
SMILES:
CC#CCOc1ccc(cc1)S(=O)(=O)N1CCSC2(CCCC2)C1C(=O)NO
Structure:
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