Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5006811 | 0.85 | GSK3B (0.43) | HDAC3ALDH1A1CYP3A4CYP2D6MAPT | |
| SCHEMBL5007313 | 0.84 | SMN1; SMN2 (0.42) | ALDH1A1MAPTRAB9ANPC1HPGD | |
| SCHEMBL2395037 | 0.80 | GSK3B (0.39) | HDAC3ALDH1A1MAPTMAPK1KMT2A | |
| SCHEMBL2395007 | 0.80 | MAPT (0.48) | ALDH1A1MAPTMAPK1KMT2APOLB | |
| SCHEMBL18085386 | 0.80 | ALDH1A1 (0.47) | HDAC3ALDH1A1CYP2D6MAPTMAPK1 | |
| SCHEMBL585945 | 0.80 | ALDH1A1 (0.47) | HDAC3ALDH1A1CYP2D6MAPTMAPK1 | |
| SCHEMBL12430069 | 0.77 | NPSR1 (0.45) | HDAC3ALDH1A1CYP3A4CYP2D6MAPT | |
| SCHEMBL1748056 | 0.76 | NPSR1 (0.47) | HDAC3ALDH1A1CYP3A4CYP2D6MAPT | |
| SCHEMBL7861847 | 0.76 | HSP90AA1 (0.50) | HDAC3ALDH1A1CYP3A4CYP2D6MAPT | |
| SCHEMBL10207876 | 0.72 | FFAR1 (0.39) | ALDH1A1MAPK1CYP2C19KMT2APOLB |
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-7423156-B2 | Preparation and use of aryl alkyl acid derivatives for the treatment of obesity | BAYER PHARMACEUTICALS CORPORATION (US) | 2008-09-09 | — | — | US | disclosed |