Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.70 |
| ▸ | CYP2A6 | P11509 | 7/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.58 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.53 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14644389 | 0.86 | PRKCI (0.55) | TRPV1HDAC1HDAC2HDAC8HDAC3 | |
| SCHEMBL14644383 | 0.85 | TRPV1 (0.70) | TRPV1CYP2A6CYP2C19CYP2C9CYP2E1 | |
| SCHEMBL17203122 | 0.84 | TRPV1 (0.65) | TRPV1CYP2A6CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL17205531 | 0.82 | TRPV1 (1.00) | TRPV1CYP2A6CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL14644384 | 0.79 | TRPV1 (0.48) | TRPV1HDAC1HDAC2HDAC8HDAC3 | |
| SCHEMBL17205617 | 0.78 | TRPV1 (1.00) | TRPV1CYP2A6CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL17203192 | 0.76 | TRPV1 (1.00) | TRPV1CYP2C19CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL3609841 | 0.74 | CYP2A6 (0.71) | TRPV1CYP2A6CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL3607664 | 0.74 | CYP2A6 (1.00) | TRPV1CYP2A6CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL12251221 | 0.72 | MKNK1 (0.58) | CYP2A6CYP2C19CYP2C9CYP3A4MKNK1 |
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-2013007792-A1 | NOVEL TH2 POLARIZING COMPOUNDS | THURGAUISCHE STIFTUNG FÜR WISSENSCHAFT UND FORSCHUNG (CH) | 2013-01-17 | — | — | WO | disclosed |