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TargetCollagenase 3
LigandBDBM50194306
Substrate/Competitorn/a
Meas. Tech.ChEMBL_458357 (CHEMBL941691)
IC50 0.35±n/a nM
Citation Freeman-Cook, KDReiter, LANoe, MCAntipas, ASDanley, DEDatta, KDowns, JTEisenbeis, SEskra, JDGarmene, DJGreer, EMGriffiths, RJGuzman, RHardink, JRJanat, FJones, CSMartinelli, GJMitchell, PGLaird, ERLiras, JLLopresti-Morrow, LLPandit, JReilly, UDRobertson, DVaughn-Bowser, MLWolf-Gouviea, LAYocum, SA Potent, selective spiropyrrolidine pyrimidinetrione inhibitors of MMP-13. Bioorg Med Chem Lett17:6529-34 (2007) [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:
BDBM50194306
n/a
NameBDBM50194306
Synonyms:5-(2-ethoxyethyl)-5-(4-(4-(4-(3-fluorophenyl)oxazol-2-yl)phenoxy)phenoxy)pyrimidine-2,4,6(1H,3H,5H)-trione | CHEMBL220904
TypeSmall organic molecule
Emp. Form.C29H24FN3O7
Mol. Mass.545.5152
SMILESCCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nc(co3)-c3cccc(F)c3)cc2)C(=O)NC(=O)NC1=O
Structure
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