Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 5/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10019244 | 0.82 | MAPK1 (0.44) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA | |
| SCHEMBL14034630 | 0.79 | AR (0.52) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA | |
| SCHEMBL14034635 | 0.78 | AR (0.48) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA | |
| SCHEMBL18724536 | 0.78 | SIRT2 (0.45) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA | |
| SCHEMBL11686557 | 0.75 | MAPK1 (0.44) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA | |
| SCHEMBL10704412 | 0.74 | MAOA (0.56) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA | |
| SCHEMBL38662707 | 0.72 | MAOA (0.51) | MAPK1L3MBTL1MAOAMAOBKIF11 | |
| SCHEMBL10019247 | 0.72 | ALDH1A1 (0.38) | MAPK1MAOAMAOBKIF11 | |
| SCHEMBL3925562 | 0.71 | PTGS2 (0.49) | MAPK1SMN1; SMN2HSD17B10L3MBTL1GSK3B | |
| SCHEMBL23554066 | 0.71 | DDB1 (0.45) | MAPK1SMN1; SMN2HSD17B10L3MBTL1MAOA |
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-8101619-B2 | Phenylpiperazine derivatives with a combination of partial dopamine-D2 receptor agonism and serotonin reuptake inhibition | SOLVAY PHARMACEUTICALS B.V. (NL) | 2012-01-24 | — | — | US | disclosed |