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Target
Interstitial collagenase
Ligand
BDBM50152650
Substrate
n/a
Meas. Tech.
ChEMBL_302308 (CHEMBL874107)
Ki
>300000±n/a nM
Citation
 Cook, GR; Manivannan, E; Underdahl, T; Lukacova, V; Zhang, Y; Balaz, S Synthesis and evaluation of novel oxazoline MMP inhibitors. Bioorg Med Chem Lett 14:4935-9 (2004) [PubMed]  Article 
Target
Name:
Interstitial collagenase
Synonyms:
CLG | Fibroblast collagenase | MMP1 | MMP1_HUMAN | Matrix metalloproteinase-1 | Matrix metalloproteinase-1 (MMP-1)
Type:
Enzyme
Mol. Mass.:
54010.26
Organism:
Homo sapiens (Human)
Description:
P03956
Residue:
469
Sequence:
MHSFPPLLLLLFWGVVSHSFPATLETQEQDVDLVQKYLEKYYNLKNDGRQVEKRRNSGPVVEKLKQMQEFFGLKVTGKPDAETLKVMKQPRCGVPDVAQFVLTEGNPRWEQTHLTYRIENYTPDLPRADVDHAIEKAFQLWSNVTPLTFTKVSEGQADIMISFVRGDHRDNSPFDGPGGNLAHAFQPGPGIGGDAHFDEDERWTNNFREYNLHRVAAHELGHSLGLSHSTDIGALMYPSYTFSGDVQLAQDDIDGIQAIYGRSQNPVQPIGPQTPKACDSKLTFDAITTIRGEVMFFKDRFYMRTNPFYPEVELNFISVFWPQLPNGLEAAYEFADRDEVRFFKGNKYWAVQGQNVLHGYPKDIYSSFGFPRTVKHIDAALSEENTGKTYFFVANKYWRYDEYKRSMDPGYPKMIAHDFPGIGHKVDAVFMKDGFFYFFHGTRQYKFDPKTKRILTLQKANSWFNCRKN
  
Inhibitor
Name:
BDBM50152650
Synonyms:
CHEMBL186648 | {(4S,5S)-2-[2-(4-Bromo-phenyl)-vinyl]-5-vinyl-4,5-dihydro-oxazol-4-yl}-methanol
Type:
Small organic molecule
Emp. Form.:
C14H14BrNO2
Mol. Mass.:
308.17
SMILES:
OC[C@@H]1N=C(O[C@H]1C=C)\C=C\c1ccc(Br)cc1 |c:3|
Structure:
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