Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.46 |
| ▸ | HTR7 | P34969 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8308233 | 0.92 | CHRM4 (0.47) | DRD2CHRM4HTR7CYP3A4CYP2C9 | |
| SCHEMBL8312961 | 0.91 | HSP90AA1 (0.46) | DRD2CHRM4HTR7CYP3A4CYP2C9 | |
| SCHEMBL6988386 | 0.84 | CYP3A4 (0.44) | DRD2CYP3A4CYP2C9CYP2C19HSP90AA1 | |
| SCHEMBL28752620 | 0.82 | POLB (0.41) | DRD2HSP90AA1ALDH1A1L3MBTL1HTR2A | |
| SCHEMBL8307594 | 0.80 | HSD17B10 (0.43) | ALDH1A1POLB | |
| SCHEMBL13233999 | 0.77 | HSP90AA1 (0.42) | DRD2HSP90AA1HTR2AHIF1AGRIN2B | |
| SCHEMBL5969938 | 0.77 | CA12 (0.51) | CYP3A4CYP2C9CYP2C19HSP90AA1RAB9A | |
| SCHEMBL8307649 | 0.77 | CHRM4 (0.49) | DRD2CHRM4HTR7 | |
| SCHEMBL6616312 | 0.76 | HSP90AA1 (0.49) | DRD2HSP90AA1ALDH1A1HTR2AGRIN2B | |
| SCHEMBL18339371 | 0.76 | HSP90AA1 (0.49) | DRD2HSP90AA1ALDH1A1HTR2AGRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004087124-A1 | COMPOUNDS HAVING SEROTONIN 5-HT17 RECEPTOR ANTAGONIST ACTIVITY AND MUSCARINIC M4 RECEPTOR AGONIST ACTIVITY AND THEIR USE IN THE TREATMENT OF PSYCHOTIC DISORDERS | MITSUBISHI PHARMA CORPORATION (JP) | 2004-10-14 | — | — | WO | disclosed |