Reaction Details Report a problem with these data
Target
Interstitial collagenase
Ligand
BDBM50113047
Substrate
n/a
Meas. Tech.
ChEBML_105983
IC50
2200±n/a nM
Citation
Letavic, MA; Axt, MZ; Barberia, JT; Carty, TJ; Danley, DE; Geoghegan, KF; Halim, NS; Hoth, LR; Kamath, AV; Laird, ER; Lopresti-Morrow, LL; McClure, KF; Mitchell, PG; Natarajan, V; Noe, MC; Pandit, J; Reeves, L; Schulte, GK; Snow, SL; Sweeney, FJ; Tan, DH; Yu, CH Synthesis and biological activity of selective pipecolic acid-based TNF-alpha converting enzyme (TACE) inhibitors. Bioorg Med Chem Lett 12:1387-90 (2002) [PubMed] Article
More Info.:
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:
BDBM50113047
Synonyms:
(2R,4S)-4-Hydroxy-1-[4-(2-methoxy-benzyloxy)-benzenesulfonyl]-piperidine-2-carboxylic acid hydroxyamide | CHEMBL28360
Type:
Small organic molecule
Emp. Form.:
C20H24N2O7S
Mol. Mass.:
436.479
SMILES:
COc1ccccc1COc1ccc(cc1)S(=O)(=O)N1CC[C@H](O)C[C@@H]1C(=O)NO