Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.39 |
| ▸ | SELE | P16581 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17524537 | 0.83 | L3MBTL1 (0.41) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17508484 | 0.82 | TRPA1 (0.42) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17524357 | 0.76 | TRPA1 (0.50) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9749287 | 0.71 | PDGFRA (0.41) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17524479 | 0.67 | TRPA1 (0.41) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17508493 | 0.65 | SCN9A (0.38) | ICAM1SELESCN9AL3MBTL1HTT | |
| SCHEMBL17508502 | 0.65 | L3MBTL1 (0.43) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17508499 | 0.64 | TRPA1 (0.44) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9339489 | 0.64 | CA12 (0.53) | CYP1A2CYP3A4CYP2C19ICAM1SELE | |
| SCHEMBL9339488 | 0.64 | CA12 (0.53) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 |
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-2016021742-A1 | HETEROCYCLIC COMPOUNDS AS EP4 RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-02-11 | — | — | WO | disclosed |