Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 16/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | CDK8 | P49336 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | CDK7 | P50613 | 1/20 | 0.48 |
| ▸ | CDK9 | P50750 | 1/20 | 0.48 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4779491 | 0.91 | TRPV1 (0.51) | TRPV1EPHX2CCNE1CDK2CDK5 | |
| SCHEMBL4779427 | 0.91 | EPHX2 (0.51) | TRPV1CYP3A4EPHX2CCNE1CDK2 | |
| SCHEMBL4776335 | 0.91 | TRPV1 (0.53) | TRPV1ROCK1EPHX2 | |
| SCHEMBL4778894 | 0.87 | EPHX2 (0.49) | TRPV1CHEK1PIM1CDK8GSK3B | |
| SCHEMBL4778063 | 0.86 | CHRM1 (0.48) | TRPV1EPHX2CNR1 | |
| SCHEMBL4779566 | 0.84 | TRPV1 (0.50) | TRPV1EPHX2CCNE1CDK2CDK5 | |
| SCHEMBL4778224 | 0.83 | TRPV1 (0.53) | TRPV1CHEK1PIM1CDK8GSK3B | |
| SCHEMBL4780962 | 0.82 | KDM4E (0.47) | TRPV1CYP3A4EPHX2CNR1 | |
| SCHEMBL4781101 | 0.82 | EPHX2 (0.51) | TRPV1CYP3A4EPHX2CNR1 | |
| SCHEMBL4779435 | 0.80 | EPHX2 (0.51) | TRPV1EPHX2CNR1 |
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-2008010061-A2 | 3-AZABICYCLO [3.1.0] HEXANE VANILLOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION | GLENMARK PHARMACEUTICALS S.A. (US) | 2008-01-24 | — | — | WO | disclosed |