Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PRNP | P04156 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16375089 | 0.83 | HSD17B10 (0.55) | RAB9ANPC1POLBHTTALDH1A1 | |
| Hydrochloric Acid SCHEMBL16346103 | 0.82 | HSD17B10 (0.53) | RAB9ANPC1POLBHTTALDH1A1 | |
| SCHEMBL6231914 | 0.79 | CYP1A2 (0.71) | RAB9ANPC1SMN1; SMN2CYP1A2POLB | |
| SCHEMBL16346328 | 0.78 | ALDH1A1 (0.50) | RAB9ANPC1SMN1; SMN2CYP1A2HTT | |
| SCHEMBL20544168 | 0.77 | ALDH1A1 (0.59) | RAB9ANPC1SMN1; SMN2CYP1A2POLB | |
| SCHEMBL6231027 | 0.76 | CYP1A2 (0.67) | RAB9ANPC1SMN1; SMN2CYP1A2POLB | |
| SCHEMBL6232508 | 0.76 | CYP1A2 (0.67) | RAB9ANPC1SMN1; SMN2CYP1A2POLB | |
| SCHEMBL16375352 | 0.75 | ALDH1A1 (0.54) | RAB9ANPC1CYP1A2HTTALDH1A1 | |
| SCHEMBL6232251 | 0.74 | CYP1A2 (0.65) | RAB9ANPC1SMN1; SMN2CYP1A2POLB | |
| SCHEMBL9658167 | 0.74 | CYP1A2 (0.65) | RAB9ANPC1SMN1; SMN2CYP1A2POLB |
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-3019034-B1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2018-10-31 | — | — | EP | claimed |