Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 11/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.49 |
| ▸ | CYP2E1 | P05181 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.49 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17205531 | 0.71 | TRPV1 (1.00) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL17203182 | 0.70 | TRPV1 (0.62) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL17203122 | 0.70 | TRPV1 (0.65) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL6026 | 0.68 | MKNK1 (0.55) | CYP2A6CYP2C19CYP2C9CYP2D6CYP3A4 | |
| SCHEMBL3610698 | 0.68 | CYP2A6 (1.00) | CYP2A6CYP2C19CYP2C9CYP2D6CYP2E1 | |
| SCHEMBL3611935 | 0.68 | CYP2A6 (1.00) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL13035326 | 0.67 | CYP2A6 (0.60) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL3609841 | 0.67 | CYP2A6 (0.71) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL3607311 | 0.67 | CYP2A6 (0.64) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL14644393 | 0.66 | TRPV1 (0.70) | TRPV1CYP2A6CYP2C19CYP2C9CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015162216-A1 | BIARYL AMIDE OR UREA DERIVATIVES AS TRPV1 LIGANDS | UNIVERSITA' DEGLI STUDI DI SIENA (IT) | 2015-10-29 | — | — | WO | disclosed |