Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 4/20 | 0.49 |
| ▸ | FAAH | O00519 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9587576 | 0.91 | MEN1 (0.57) | HTTTSHRCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9587928 | 0.89 | CYP3A4 (0.53) | HTTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9587878 | 0.87 | CYP3A4 (0.66) | HTTTSHRCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9587002 | 0.86 | KDM4E (0.61) | HTTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9589632 | 0.85 | HSD17B10 (0.58) | CYP3A4CYP2D6CYP2C9CYP2C19POLB | |
| SCHEMBL9588899 | 0.85 | HSD17B10 (0.58) | CYP3A4CYP2D6CYP2C9CYP2C19POLB | |
| SCHEMBL9587661 | 0.84 | NPC1 (0.54) | HTTTSHRCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9587211 | 0.82 | CYP3A4 (0.49) | HTTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7298757 | 0.82 | HTT (0.62) | HTTTSHRCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9588605 | 0.81 | CHRM1 (0.59) | CYP3A4CYP2D6CYP2C9CYP2C19POLB |
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-5190974-A | Analgesics | ROUSSEL UCLAF (FR) | 1993-03-02 | — | — | US | disclosed |