Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 6/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | PRLHR | P49683 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL300543 | 1.00 | MAPK1 (0.35) | MAPK1NPC1HTTCNR1CNR2 | |
| SCHEMBL176625 | 0.86 | NPC1 (0.43) | NPC1HTTCNR1CNR2TAS1R3 | |
| SCHEMBL176477 | 0.86 | NPC1 (0.43) | NPC1HTTCNR1CNR2TAS1R3 | |
| SCHEMBL300660 | 0.83 | CNR1 (0.46) | MAPK1CNR1CNR2 | |
| SCHEMBL300525 | 0.83 | CNR1 (0.46) | MAPK1CNR1CNR2 | |
| SCHEMBL300698 | 0.79 | LIPE (0.48) | NPC1HTTCNR1CNR2 | |
| SCHEMBL300451 | 0.78 | CNR2 (0.42) | MAPK1NPC1HTTCNR1CNR2 | |
| SCHEMBL300719 | 0.78 | CNR1 (0.49) | CNR1CNR2 | |
| SCHEMBL300714 | 0.78 | CNR1 (0.48) | CNR1CNR2 | |
| SCHEMBL300391 | 0.78 | CNR1 (0.51) | CNR1CNR2TAS1R3TAS1R1 |
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 |