Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HTR3B | O95264 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | HTR3A | P46098 | 2/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.45 |
| ▸ | HTR1A | P08908 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27947668 | 0.78 | BCHE (0.56) | HRH3HTR3EKDM4EHTR3BALDH1A1 | |
| SCHEMBL6701347 | 0.76 | HRH3 (0.65) | HRH3HTR3EKDM4EHTR3BALDH1A1 | |
| SCHEMBL16269503 | 0.75 | GRM1 (0.45) | HRH3KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL5227381 | 0.75 | HRH3 (0.63) | HRH3HTR3EKDM4EHTR3BALDH1A1 | |
| SCHEMBL27515024 | 0.74 | HTR3A (0.43) | HRH3HTR3EHTR3BCYP1A2HTR3A | |
| SCHEMBL30838177 | 0.74 | OPRK1 (0.46) | — | |
| SCHEMBL6766547 | 0.73 | HTR2C (0.57) | HRH3HTR3EKDM4EHTR3BALDH1A1 | |
| SCHEMBL17767835 | 0.72 | SLC18A3 (0.43) | HRH3KDM4EALDH1A1USP2MAPK1 | |
| SCHEMBL27463873 | 0.71 | DPP4 (0.41) | HTR3EKDM4EHTR3BALDH1A1CYP1A2 | |
| SCHEMBL16269770 | 0.70 | MAPT (0.43) | HRH3KDM4EALDH1A1HRH4NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110914262-B | Kappa opioid receptor antagonists and products and methods relating thereto | 斯克里普斯研究所 | 2024-04-05 | — | — | CN | disclosed |