Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.37 |
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11214565 | 0.85 | CYP1A2 (0.48) | ALDH1A1MAPK1HSD17B10CYP1A2GAA | |
| SCHEMBL11207896 | 0.74 | MAPK1 (0.44) | ALDH1A1HPGDMAPK1HSD17B10GAA | |
| SCHEMBL22655893 | 0.69 | CDC7 (0.53) | ALDH1A1GAATRPA1TRPM8TRPV1 | |
| SCHEMBL11210678 | 0.68 | HSD17B10 (0.44) | ALDH1A1HPGDMAPK1HSD17B10CYP1A2 | |
| SCHEMBL3590783 | 0.67 | NOS1 (0.57) | ALDH1A1HPGDMAPK1GAATRPA1 | |
| SCHEMBL16834434 | 0.66 | L3MBTL1 (0.49) | ALDH1A1HPGDHSD17B10CYP1A2GAA | |
| SCHEMBL5419568 | 0.66 | NPC1 (0.58) | ALDH1A1ROCK2DYRK1AROCK1MEN1 | |
| SCHEMBL29536476 | 0.66 | MKNK1 (0.42) | MAPK1TRPA1TRPM8TRPV1ROCK2 | |
| SCHEMBL22655800 | 0.66 | MKNK1 (0.42) | MAPK1TRPA1TRPM8TRPV1ROCK2 | |
| SCHEMBL2571909 | 0.62 | ROCK2 (0.46) | ALDH1A1HPGDMAPK1ROCK2DYRK1A |
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-4333945-A | Thiazoline and imidazoline derivatives useful as minor tranquilizers | SANDOZ LTD. (CH) | 1982-06-08 | — | — | US | disclosed |