Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.41 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.41 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.41 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16840366 | 0.75 | TAS1R3 (0.58) | HPGDPOLBMAPTNPC1CYP3A4 | |
| SCHEMBL268414 | 0.74 | TDP1 (0.62) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL14373412 | 0.73 | HPGD (0.45) | HPGDSMN1; SMN2POLBNPC1MEN1 | |
| SCHEMBL12326834 | 0.72 | ALDH1A1 (0.53) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL269614 | 0.72 | AKR1C3 (0.63) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL30580504 | 0.72 | AKR1C3 (0.63) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL4273530 | 0.72 | SMN1; SMN2 (0.52) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL404510 | 0.71 | MAPT (0.51) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL4946199 | 0.71 | AKR1C3 (0.51) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 | |
| Potassium Ion SCHEMBL15876122 | 0.71 | AKR1C3 (0.51) | HPGDSMN1; SMN2AKR1B10AKR1B1AKR1C4 |
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-1976849-B1 | COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | MERCK SHARP & DOHME (US) | 2016-03-09 | — | — | EP | disclosed |