Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 7/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 3/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8329839 | 0.84 | DRD4 (0.41) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8327397 | 0.78 | GRIN2B (0.38) | DRD4CYP1A2CYP3A4CYP2C9GRIN2B | |
| SCHEMBL8328089 | 0.78 | DRD4 (0.41) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8328088 | 0.78 | DRD4 (0.41) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8329877 | 0.74 | DRD4 (0.43) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8329875 | 0.74 | DRD4 (0.43) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8329130 | 0.71 | DRD4 (0.41) | DRD4ALDH1A1TSHRCNR2HTT | |
| SCHEMBL8327547 | 0.71 | DRD4 (0.40) | DRD4CYP1A2CYP3A4CYP2C9FAAH | |
| SCHEMBL8327545 | 0.71 | DRD4 (0.40) | DRD4CYP1A2CYP3A4CYP2C9FAAH | |
| SCHEMBL8325128 | 0.70 | DRD4 (0.41) | DRD4ALDH1A1TSHRCNR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0760368-B1 | PYRIMIDINE DERIVATIVES | NISSHIN FLOUR MILLING CO (JP) | 1999-07-28 | — | — | EP | disclosed |
| EP-0760368-A1 | NOVEL PYRIMIDINE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |