Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 9/20 | 1.00 |
| ▸ | MMP1 | P03956 | 9/20 | 0.64 |
| ▸ | PDE4A | P27815 | 5/20 | 0.61 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.61 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.61 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.61 |
| ▸ | MMP2 | P08253 | 4/20 | 0.61 |
| ▸ | MMP3 | P08254 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7207560 | 0.86 | MMP13 (0.75) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL7407018 | 0.84 | MMP13 (0.72) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL7212123 | 0.78 | MMP1 (1.00) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL7207785 | 0.78 | PDE4A (0.77) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL7207026 | 0.77 | MMP13 (0.68) | MMP13MMP1MMP2MMP3MMP8 | |
| SCHEMBL29160472 | 0.77 | ALDH1A1 (0.90) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL15617705 | 0.77 | NPC1 (0.69) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL6823156 | 0.76 | MMP2 (1.00) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL7207764 | 0.75 | MMP13 (1.00) | MMP13MMP1PDE4APDE4BPDE4C | |
| SCHEMBL7212134 | 0.74 | MMP13 (1.00) | MMP13MMP1PDE4APDE4BPDE4C |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0939628-B1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO CO (US) | 2003-03-05 | — | — | EP | disclosed |
| US-6013649-A | BOND DISORDERS; AUTOIMMUNE DISEASES; ANTITUMOR AGENTS | MONSANTO COMPANY (US) | 2000-01-11 | — | — | US | disclosed |
| EP-0939628-A4 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO CO (US) | 1999-12-22 | — | — | EP | disclosed |
| EP-0939628-A1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1999-09-08 | — | — | EP | disclosed |
| WO-1998003164-A1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1998-01-29 | — | — | WO | disclosed |