Reaction Details
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Target
Collagenase 3
Ligand
BDBM50194289
Substrate
n/a
Meas. Tech.
ChEMBL_424283 (CHEMBL908435)
IC50
0.68±n/a nM
Citation
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More Info.:
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:
BDBM50194289
Synonyms:
5-(2-ethoxy-ethyl)-5-(4-{4-[4-(4-fluoro-phenyl)-oxazol-2-yl]-phenoxy}-phenoxy)-pyrimidine-2,4,6-trione | 5-(2-ethoxyethyl)-5-(4-(4-(4-(4-fluorophenyl)oxazol-2-yl)phenoxy)phenoxy)pyrimidine-2,4,6(1H,3H,5H)-trione | CHEMBL220957
Type:
Small organic molecule
Emp. Form.:
C29H24FN3O7
Mol. Mass.:
545.5152
SMILES:
CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nc(co3)-c3ccc(F)cc3)cc2)C(=O)NC(=O)NC1=O