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TargetCollagenase 3
LigandBDBM46421
Substrate/Competitorn/a
Meas. Tech.ChEMBL_754229 (CHEMBL1798873)
IC50 10000±n/a nM
Citation De Savi, CMorley, ADTing, ANash, IKarabelas, KWood, CMJames, MNorris, SJKaroutchi, GRankine, NHamlin, GMacfaul, PARyan, DBaker, SVHargreaves, DGerhardt, S Selective non zinc binding inhibitors of MMP13. Bioorg Med Chem Lett21:4215-9 (2011) [PubMed]  Article
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:
BDBM46421
n/a
NameBDBM46421
Synonyms:4-(4-methylphenoxy)-N-(4-pyridinylmethyl)benzenecarboxamide | 4-(4-methylphenoxy)-N-(4-pyridylmethyl)benzamide | 4-(4-methylphenoxy)-N-(pyridin-4-ylmethyl)benzamide | MLS000755676 | SMR000337350 | cid_4358655
TypeSmall organic molecule
Emp. Form.C20H18N2O2
Mol. Mass.318.3691
SMILESCc1ccc(Oc2ccc(cc2)C(=O)NCc2ccncc2)cc1
Structure
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