Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | AGPAT2 | O15120 | 6/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.40 |
| ▸ | TERT | O14746 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5743755 | 0.91 | KDM4E (0.55) | KDM4EHSD17B10ALDH1A1AGPAT2MCHR1 | |
| SCHEMBL5742129 | 0.90 | KDM4E (0.55) | KDM4EHSD17B10ALDH1A1AGPAT2MCHR1 | |
| SCHEMBL5740994 | 0.89 | PDE4D (0.47) | KDM4EHSD17B10ALDH1A1AGPAT2CYP3A4 | |
| SCHEMBL5741991 | 0.89 | AGPAT2 (0.57) | KDM4EHSD17B10ALDH1A1AGPAT2NPC1 | |
| SCHEMBL5742875 | 0.89 | AGPAT2 (0.57) | KDM4EHSD17B10ALDH1A1AGPAT2NPC1 | |
| SCHEMBL5742668 | 0.87 | KDM4E (0.58) | KDM4EHSD17B10ALDH1A1RAB9AACHE | |
| SCHEMBL5740139 | 0.85 | AGPAT2 (0.60) | KDM4EHSD17B10ALDH1A1AGPAT2NPC1 | |
| SCHEMBL5741862 | 0.84 | AGPAT2 (0.57) | KDM4EHSD17B10ALDH1A1AGPAT2MCHR1 | |
| SCHEMBL5740513 | 0.84 | KDM4E (0.44) | KDM4EHSD17B10AGPAT2MCHR1ACHE | |
| SCHEMBL5740529 | 0.83 | MCHR1 (0.53) | AGPAT2MCHR1ROCK2DOT1LTERT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1339706-B1 | N-TYPE CALCIUM CHANNEL ANTAGONISTS FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | EP | disclosed |