Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 5/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 2/20 | 0.33 |
| ▸ | RARB | P10826 | 2/20 | 0.33 |
| ▸ | RARG | P13631 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2311893 | 0.85 | NPC1 (0.35) | DGAT1HSD17B10PDE4DRARARARB | |
| SCHEMBL2309580 | 0.83 | DGAT1 (0.41) | DGAT1KDM4ELMNAHSD17B10PDE4D | |
| SCHEMBL1748043 | 0.79 | ALDH1A1 (0.38) | HDAC1HDAC3HDAC2KDM4ELMNA | |
| SCHEMBL1748045 | 0.79 | ALDH1A1 (0.38) | HDAC1HDAC3HDAC2KDM4ELMNA | |
| SCHEMBL1748044 | 0.79 | ALDH1A1 (0.38) | HDAC1HDAC3HDAC2KDM4ELMNA | |
| SCHEMBL2635426 | 0.74 | DGAT1 (0.60) | DGAT1HDAC1HDAC6 | |
| SCHEMBL4923255 | 0.74 | HSD17B1 (0.39) | HDAC1HDAC3HDAC2KDM4E | |
| SCHEMBL1748065 | 0.74 | DGAT1 (0.41) | DGAT1HDAC6KDM4EHSD17B10 | |
| SCHEMBL14074139 | 0.73 | DGAT1 (0.46) | DGAT1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL1748238 | 0.73 | DGAT1 (0.42) | DGAT1HDAC6KDM4EHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8013166-B2 | Preparation and use of aryl alkyl acid derivatives for the treatment of obesity | BAYER HEALTHCARE LLC (US) | 2011-09-06 | — | — | US | disclosed |
| 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 |