Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.41 |
| ▸ | CA4 | P22748 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9991008 | 0.81 | ALDH1A1 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL14133234 | 0.77 | NPC1 (0.49) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL44422 | 0.74 | NPC1 (0.65) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL11530601 | 0.73 | CYP1A2 (0.50) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| Hydrochloric Acid SCHEMBL28572130 | 0.73 | NPC1 (0.62) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL13359635 | 0.73 | NPC1 (0.49) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL18529892 | 0.72 | NPC1 (0.57) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL9546819 | 0.70 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2CA1CA2CA4 | |
| SCHEMBL13325712 | 0.69 | NPC1 (0.45) | ALDH1A1NPC1RAB9ASMN1; SMN2IDO1 | |
| SCHEMBL4487634 | 0.69 | KDM4E (0.72) | ALDH1A1SMN1; SMN2CA1CA2CA4 |
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-3334808-A1 | IMPROVED ANTIOXIDANT COMPOSITIONS AND LUBRICATING COMPOSITIONS CONTAINING THE SAME | Vanderbilt Chemicals, LLC (US) | 2018-06-20 | — | — | EP | disclosed |
| WO-2017030784-A1 | IMPROVED ANTIOXIDANT COMPOSITIONS AND LUBRICATING COMPOSITIONS CONTAINING THE SAME | VANDERBILT CHEMICALS, LLC (US) | 2017-02-23 | — | — | WO | disclosed |