Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.66 |
| ▸ | DRD2 | P14416 | 8/20 | 0.56 |
| ▸ | DRD3 | P35462 | 8/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.56 |
| ▸ | DRD4 | P21917 | 4/20 | 0.47 |
| ▸ | HTR2A | P28223 | 3/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL9725055 | 0.94 | HTR1A (0.64) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL9725005 | 0.80 | HTR1A (1.00) | HTR1ADRD2DRD3DRD4HTR2A | |
| SCHEMBL9724927 | 0.77 | HTR1A (0.87) | HTR1ADRD2DRD3DRD4HTR2A | |
| SCHEMBL9725026 | 0.74 | HTR1A (0.70) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL24684789 | 0.72 | OPRM1 (1.00) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL9725045 | 0.71 | HTR1A (0.84) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL27981489 | 0.69 | HRH3 (0.56) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL28773706 | 0.69 | HRH3 (0.55) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL7109637 | 0.69 | HTR1A (0.52) | HTR1ADRD2DRD3OPRM1DRD4 | |
| SCHEMBL9725016 | 0.69 | HTR1A (0.73) | HTR1ADRD2DRD3OPRM1DRD4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5135931-A | Antidepressants, psychological disorders, nervous system disorders | AKZO N.V. (NL) | 1992-08-04 | — | — | US | disclosed |
| EP-0462638-A1 | Pyridinylpiperazine derivatives | Akzo Nobel N.V. (NL) | 1991-12-27 | — | — | EP | disclosed |