Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 13/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 8/20 | 0.48 |
| ▸ | DRD2 | P14416 | 5/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL27692703 | 0.81 | DRD4 (0.63) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13059802 | 0.81 | DRD4 (0.59) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5378301 | 0.81 | DRD4 (0.59) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18487141 | 0.79 | HPGD (0.55) | DRD4DRD3DRD2ALDH1A1SMN1; SMN2 | |
| SCHEMBL5870772 | 0.79 | DRD4 (0.54) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7461271 | 0.77 | DRD4 (0.46) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL14425319 | 0.76 | DRD4 (0.56) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5366013 | 0.76 | DRD4 (0.56) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28806254 | 0.74 | DRD4 (0.48) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9523708 | 0.73 | CNR2 (0.58) | DRD4DRD3SLC6A3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2168952-B1 | MORPHOLINE DERIVATIVES AS RENIN INHIBITORS | MITSUBISHI TANABE PHARMA CORP (JP) | 2017-02-15 | — | — | EP | disclosed |