Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 20/20 | 0.79 |
| ▸ | CNR2 | P34972 | 4/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL5561833 | 0.88 | CNR1 (1.00) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5566010 | 0.88 | CNR1 (1.00) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5561176 | 0.88 | CNR1 (1.00) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5567239 | 0.87 | CNR1 (0.78) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5566325 | 0.87 | CNR1 (0.98) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5567763 | 0.87 | CNR1 (0.83) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL5643095 | 0.86 | CNR1 (1.00) | CNR1CNR2 | |
| SCHEMBL5566447 | 0.86 | CNR1 (0.81) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14536669 | 0.85 | CNR1 (0.64) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5561855 | 0.84 | CNR1 (0.79) | CNR1CNR2CYP3A4CYP2D6CYP2C9 |
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-1549637-B1 | 1- (INDOL-3-YL)CARBONYL PIPERAZINE DERIVATIVES | ORGANON NV (NL) | 2007-05-02 | — | — | EP | disclosed |