| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Macrophage metalloelastase |
|---|
| Ligand | BDBM50239954 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | ChEMBL_1667637 (CHEMBL4017433) |
|---|
| IC50 | 1800±n/a nM |
|---|
| Citation |  Choi, JY; Fuerst, R; Knapinska, AM; Taylor, AB; Smith, L; Cao, X; Hart, PJ; Fields, GB; Roush, WR Structure-Based Design and Synthesis of Potent and Selective Matrix Metalloproteinase 13 Inhibitors. J Med Chem60:5816-5825 (2017) [PubMed] Article |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Macrophage metalloelastase |
|---|
| Name: | Macrophage metalloelastase |
|---|
| Synonyms: | HME | MMP12 | MMP12_HUMAN | Matrix metalloproteinase 12 | Matrix metalloproteinase-12 (MMP 12) | Matrix metalloproteinase-12 (MMP-12) | Matrix metalloproteinase-12 (MMP12) | Matrix metalloproteinases 12 (MMP-12) |
|---|
| Type: | Enzyme |
|---|
| Mol. Mass.: | 54012.99 |
|---|
| Organism: | Homo sapiens (Human) |
|---|
| Description: | P39900 |
|---|
| Residue: | 470 |
|---|
| Sequence: | MKFLLILLLQATASGALPLNSSTSLEKNNVLFGERYLEKFYGLEINKLPVTKMKYSGNLM
KEKIQEMQHFLGLKVTGQLDTSTLEMMHAPRCGVPDVHHFREMPGGPVWRKHYITYRINN
YTPDMNREDVDYAIRKAFQVWSNVTPLKFSKINTGMADILVVFARGAHGDFHAFDGKGGI
LAHAFGPGSGIGGDAHFDEDEFWTTHSGGTNLFLTAVHEIGHSLGLGHSSDPKAVMFPTY
KYVDINTFRLSADDIRGIQSLYGDPKENQRLPNPDNSEPALCDPNLSFDAVTTVGNKIFF
FKDRFFWLKVSERPKTSVNLISSLWPTLPSGIEAAYEIEARNQVFLFKDDKYWLISNLRP
EPNYPKSIHSFGFPNFVKKIDAAVFNPRFYRTYFFVDNQYWRYDERRQMMDPGYPKLITK
NFQGIGPKIDAVFYSKNKYYYFFQGSNQFEYDFLLQRITKTLKSNSWFGC
|
|
|
|---|
| BDBM50239954 |
|---|
| n/a |
|---|
| Name | BDBM50239954 |
|---|
| Synonyms: | CHEMBL4080520 |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C25H27FN4O4S |
|---|
| Mol. Mass. | 498.57 |
|---|
| SMILES | CNC(=O)[C@@H](NC(=O)c1ccc(o1)-c1ccc(CSc2nc3CCCc3c(=O)[nH]2)c(F)c1)C(C)C |r| |
|---|
| Structure | 
|
|---|
Search and Browse
