Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 4/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | GPX4 | P36969 | 4/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | BCL2 | P10415 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL977897 | 0.76 | CYP3A4 (0.42) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 | |
| SCHEMBL3297472 | 0.75 | CYP3A4 (0.47) | SLC6A9CYP2D6CHRM2HTR1AADRA2A | |
| SCHEMBL1780961 | 0.73 | CYP2D6 (0.52) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 | |
| SCHEMBL3296307 | 0.72 | CYP19A1 (0.42) | SLC6A9CYP19A1GPX4KCNH2TSHR | |
| SCHEMBL2913392 | 0.70 | CRHBP (0.47) | HTR1AALDH1A1 | |
| SCHEMBL1780960 | 0.70 | CYP2D6 (0.52) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 | |
| SCHEMBL2905814 | 0.70 | CYP2D6 (0.52) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 | |
| SCHEMBL2914551 | 0.70 | CYP3A4 (0.40) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 | |
| SCHEMBL1500596 | 0.70 | CYP2D6 (0.52) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 | |
| SCHEMBL14034023 | 0.69 | CYP2D6 (0.51) | SLC6A9CYP2D6CYP19A1GPX4CHRM2 |
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-6355631-B1 | TREATMENT OF PSYCHOSIS AND SCHIZOPHRENIA | AVENTIS PHARMA S.A. (FR) | 2002-03-12 | — | — | US | disclosed |