Reaction Details Report a problem with these data
Target
Interstitial collagenase
Ligand
BDBM50100927
Substrate
n/a
Meas. Tech.
ChEBML_106109
IC50
4600±n/a nM
Citation
Curtin, ML; Florjancic, AS; Heyman, HR; Michaelides, MR; Garland, RB; Holms, JH; Steinman, DH; Dellaria, JF; Gong, J; Wada, CK; Guo, Y; Elmore, IB; Tapang, P; Albert, DH; Magoc, TJ; Marcotte, PA; Bouska, JJ; Goodfellow, CL; Bauch, JL; Marsh, KC; Morgan, DW; Davidsen, SK Discovery and characterization of the potent, selective and orally bioavailable MMP inhibitor ABT-770. Bioorg Med Chem Lett 11:1557-60 (2001) [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:
BDBM50100927
Synonyms:
(S)-N-(1-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-3-(4'-(trifluoromethoxy)biphenyl-4-yloxy)propan-2-yl)-N-hydroxyformamide | CHEMBL40143 | N-[(S)-2-(4,4-Dimethyl-2,5-dioxo-imidazolidin-1-yl)-1-(4'-trifluoromethoxy-biphenyl-4-yloxymethyl)-ethyl]-N-hydroxy-formamide
Type:
Small organic molecule
Emp. Form.:
C22H22F3N3O6
Mol. Mass.:
481.4218
SMILES:
CC1(C)NC(=O)N(C[C@@H](COc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C1=O |r|