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Target
Collagenase 3
Ligand
BDBM50427870
Substrate
n/a
Meas. Tech.
ChEMBL_940799 (CHEMBL2330245)
IC50
386±n/a nM
Citation
 Casalini, F; Fugazza, L; Esposito, G; Cabella, C; Brioschi, C; Cordaro, A; D'Angeli, L; Bartoli, A; Filannino, AM; Gringeri, CV; Longo, DL; Muzio, V; Nuti, E; Orlandini, E; Figlia, G; Quattrini, A; Tei, L; Digilio, G; Rossello, A; Maiocchi, A Synthesis and preliminary evaluation in tumor bearing mice of new (18)F-labeled arylsulfone matrix metalloproteinase inhibitors as tracers for positron emission tomography. J Med Chem 56:2676-89 (2013) [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:
Homo sapiens (Human)
Description:
P45452
Residue:
471
Sequence:
MHPGVLAAFLFLSWTHCRALPLPSGGDEDDLSEEDLQFAERYLRSYYHPTNLAGILKENAASSMTERLREMQSFFGLEVTGKLDDNTLDVMKKPRCGVPDVGEYNVFPRTLKWSKMNLTYRIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDGPSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALMFPIYTYTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPDKCDPSLSLDAITSLRGETMIFKDRFFWRLHPQQVDAELFLTKSFWPELPNRIDAAYEHPSHDLIFIFRGRKFWALNGYDILEGYPKKISELGLPKEVKKISAAVHFEDTGKTLLFSGNQVWRYDDTNHIMDKDYPRLIEEDFPGIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPANSILWC
  
Inhibitor
Name:
BDBM50427870
Synonyms:
CHEMBL2326364
Type:
Small organic molecule
Emp. Form.:
C20H15FO4S
Mol. Mass.:
370.394
SMILES:
OC(=O)Cc1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1
Structure:
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