Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 8/20 | 0.51 |
| ▸ | HSD17B2 | P37059 | 7/20 | 0.51 |
| ▸ | APP | P05067 | 4/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL1748057 | 0.87 | MAPT (0.58) | DYRK1ACYP3A4CYP2C9CYP2C19RAB9A | |
| SCHEMBL12593856 | 0.85 | NPC1 (0.52) | APPDYRK1ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1747973 | 0.83 | NPC1 (0.56) | RAB9ANPC1KDM4EMEN1ALDH1A1 | |
| SCHEMBL1747917 | 0.82 | DYRK1A (0.51) | DYRK1ACYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL1748356 | 0.81 | RAB9A (0.47) | DYRK1ACYP3A4CYP2C9CYP2C19RAB9A | |
| SCHEMBL1748255 | 0.81 | NPC1 (0.60) | DYRK1ACYP3A4CYP2C19RAB9ANPC1 | |
| SCHEMBL1748062 | 0.80 | DGAT1 (0.55) | DYRK1ACYP3A4CYP2C9RAB9ANPC1 | |
| SCHEMBL1748216 | 0.75 | DYRK1A (0.51) | DYRK1ARAB9ANPC1MAPT | |
| SCHEMBL1748331 | 0.75 | DYRK1A (0.41) | DYRK1ARAB9ANPC1DYRK1BKDM4E | |
| SCHEMBL1748096 | 0.72 | NPC1 (0.43) | DYRK1ARAB9ANPC1DYRK1BKDM4E |
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-1633722-B1 | PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY | BAYER HEALTHCARE LLC (US) | 2011-08-03 | — | — | EP | disclosed |