Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 5/20 | 0.72 |
| ▸ | PDE4A | P27815 | 6/20 | 0.65 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.65 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.65 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.65 |
| ▸ | MMP2 | P08253 | 5/20 | 0.65 |
| ▸ | MMP3 | P08254 | 5/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | MMP1 | P03956 | 8/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16886398 | 0.85 | MMP13 (0.50) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7207560 | 0.84 | MMP13 (0.75) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7208439 | 0.84 | MMP13 (1.00) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7207785 | 0.81 | PDE4A (0.77) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL29160472 | 0.80 | ALDH1A1 (0.90) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL15617705 | 0.80 | NPC1 (0.69) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6823156 | 0.79 | MMP2 (1.00) | MMP13PDE4APDE4BPDE4CPDE4D | |
| Hydroxyamine SCHEMBL8164284 | 0.74 | PDE4A (0.75) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL19065155 | 0.74 | PDE4A (0.57) | MMP13PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6774277 | 0.74 | ALDH1A1 (0.60) | MMP13PDE4APDE4BPDE4CPDE4D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |