Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | HPN | P05981 | 3/20 | 0.46 |
| ▸ | ST14 | Q9Y5Y6 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HGFAC | Q04756 | 1/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 2/20 | 0.43 |
| ▸ | F11 | P03951 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6409170 | 0.88 | TP53 (0.47) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL6412715 | 0.88 | TP53 (0.56) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL2403293 | 0.85 | ALDH1A1 (0.48) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL6409811 | 0.81 | TP53 (0.53) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL2401027 | 0.77 | ALDH1A1 (0.48) | ALDH1A1MAPK1 | |
| SCHEMBL6409841 | 0.75 | TP53 (0.46) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL22500544 | 0.73 | KMT2A (0.70) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL22500546 | 0.73 | KMT2A (0.70) | TP53HPNST14KMT2AHGFAC | |
| SCHEMBL2579196 | 0.73 | ALDH1A1 (0.45) | KMT2ACTSLHTTALDH1A1MEN1 | |
| SCHEMBL2400743 | 0.72 | ALDH1A1 (0.49) | KMT2ACTSLHTTALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8048890-B2 | Analgesics; neuropathic pain; headaches; muscle relaxants; incontence; tinnitus; diarrhea; antiarrhythmia agents; antiischemic agents; antiinflammatory agents; antiulcer agents; antidepressants; antiepileptic agents | GRUENENTHAL GMBH (DE) | 2011-11-01 | — | — | US | claimed |
| US-8048890-B2 | Analgesics; neuropathic pain; headaches; muscle relaxants; incontence; tinnitus; diarrhea; antiarrhythmia agents; antiischemic agents; antiinflammatory agents; antiulcer agents; antidepressants; antiepileptic agents | GRUENENTHAL GMBH (DE) | 2011-11-01 | — | — | US | disclosed |