Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.65 |
| ▸ | MAOB | P27338 | 1/20 | 0.65 |
| ▸ | AHR | P35869 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 5/20 | 0.40 |
| ▸ | DRD4 | P21917 | 5/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30587831 | 1.00 | MAOA (0.65) | MAOAMAOBAHRCYP1A2CYP3A4 | |
| SCHEMBL8815141 | 0.89 | MAOA (0.65) | MAOAMAOBAHRCYP1A2CYP3A4 | |
| SCHEMBL23372333 | 0.86 | MAOA (0.57) | MAOAMAOBCYP1A2CYP3A4MAPT | |
| SCHEMBL9455528 | 0.81 | MAOA (0.81) | MAOAMAOBAHRGAANPSR1 | |
| Xanthene SCHEMBL30586075 | 0.81 | MAOA (1.00) | MAOAMAOBAHRCYP1A2HTR2A | |
| Xanthene SCHEMBL29378346 | 0.81 | MAOA (1.00) | MAOAMAOBAHRCYP1A2HTR2A | |
| Xanthene SCHEMBL27493963 | 0.81 | MAOA (1.00) | MAOAMAOBAHRCYP1A2HTR2A | |
| Xanthene SCHEMBL4267 | 0.81 | MAOA (1.00) | MAOAMAOBAHRCYP1A2HTR2A | |
| Xanthene SCHEMBL9339684 | 0.81 | MAOA (1.00) | MAOAMAOBAHRCYP1A2HTR2A | |
| SCHEMBL8816329 | 0.81 | MAOA (0.65) | MAOAMAOBAHRDRD2DRD1 |
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-1997006178-A1 | PYRIMIDINE NUCLEOSIDES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-02-20 | — | — | WO | disclosed |