Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 4/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP3 | P08254 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7207971 | 0.91 | MMP13 (0.48) | MMP13CA1CA2ACHEATM | |
| SCHEMBL7867074 | 0.79 | MMP13 (0.51) | MMP13CA1CA2ACHEATM | |
| SCHEMBL7869903 | 0.77 | MMP13 (0.57) | MMP13CA1CA2ACHEATM | |
| SCHEMBL7208364 | 0.77 | MMP13 (0.52) | MMP13CA1CA2MMP2CYP3A4 | |
| SCHEMBL7207972 | 0.76 | MMP1 (0.45) | MMP13CA1CA2ACHEATM | |
| SCHEMBL7862165 | 0.76 | NPC1 (0.52) | MMP13CA1CA2MMP2MMP3 | |
| SCHEMBL7185942 | 0.75 | MMP13 (0.67) | MMP13CA2MMP2MMP3CYP3A4 | |
| SCHEMBL7185940 | 0.75 | MMP13 (0.67) | MMP13CA2MMP2MMP3CYP3A4 | |
| SCHEMBL10883284 | 0.75 | KMT2A (0.59) | ATMCTSLCTSSCTSKALDH1A1 | |
| SCHEMBL8601705 | 0.74 | MMP13 (0.49) | MMP13CA1CA2ACHEATM |
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 2 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 |