Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 11/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | UGCG | Q16739 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13871311 | 0.86 | CNR2 (0.48) | PTGS2CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL300538 | 0.80 | CNR2 (0.39) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL300671 | 0.80 | CNR2 (0.39) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL300508 | 0.78 | CNR2 (0.46) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL300484 | 0.78 | CNR2 (0.51) | CNR2CNR1 | |
| SCHEMBL2715695 | 0.76 | CNR2 (0.50) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL2715683 | 0.76 | CNR2 (0.57) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL13871490 | 0.76 | CNR2 (0.57) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL2715958 | 0.76 | CNR2 (0.54) | CNR2TAS1R3TAS1R1CNR1 | |
| SCHEMBL13871306 | 0.75 | CNR2 (0.56) | CNR2TAS1R3TAS1R1CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1937259-B1 | HEXAHYDRO-CYCLOHEPTAPYRAZOLE CANNABINOID MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-11-23 | — | — | EP | claimed |