Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | METAP1 | P53582 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9851135 | 0.79 | TDP1 (0.59) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11159476 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL899333 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| Icodulinum SCHEMBL380085 | 0.77 | NPC1 (0.47) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28924950 | 0.77 | CYP1A2 (0.64) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6195917 | 0.77 | ALDH1A1 (0.54) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| Icodulinum SCHEMBL2746827 | 0.76 | NPC1 (0.46) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30015045 | 0.76 | ALDH1A1 (0.54) | ALDH1A1TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL899473 | 0.75 | ALDH1A1 (0.57) | ALDH1A1TDP1NPC1RAB9AALOX5 | |
| SCHEMBL18550722 | 0.75 | ALDH1A1 (0.59) | ALDH1A1TDP1NPC1RAB9APKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-118546107-A | 2-Thiazole aminophenol derivatives and application thereof | 中国药科大学 | 2024-08-27 | — | — | CN | claimed |