Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | APP | P05067 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | BCR | P11274 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11050461 | 0.92 | ABL1 (0.50) | MAPK1ALDH1A1CYP3A4APPSMN1; SMN2 | |
| SCHEMBL11047143 | 0.88 | TDP1 (0.47) | TDP1MAPK1ALDH1A1CYP3A4APP | |
| Perchlorate SCHEMBL11044030 | 0.88 | TDP1 (0.50) | TDP1MAPK1ALDH1A1CYP3A4APP | |
| SCHEMBL8744514 | 0.87 | ABL1 (0.50) | TDP1MAPK1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL11154713 | 0.87 | ABL1 (0.50) | TDP1MAPK1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL10601690 | 0.87 | ABL1 (0.50) | TDP1MAPK1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL11045692 | 0.87 | ABL1 (0.50) | TDP1MAPK1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6688965 | 0.85 | NPC1 (0.55) | MAPK1ALDH1A1APPSMN1; SMN2NPC1 | |
| SCHEMBL9637531 | 0.82 | NPC1 (0.50) | TDP1MAPK1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL9175782 | 0.82 | MAOB (0.41) | MAPK1ALDH1A1SMN1; SMN2NPC1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-4474868-A | ORGANIC PEROXIDE AND COMPOUND CONTAINING CATIONIC OXYGEN, SULFUR OXYGEN,SULFUR OR SELENIUM | NIPPON OIL AND FATS CO., LTD. (JP) | 1984-10-02 | — | — | US | disclosed |