Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 15/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.31 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.31 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5795343 | 0.87 | CNR1 (0.47) | CNR1CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL13114724 | 0.83 | CNR1 (0.54) | CNR1CYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL3550428 | 0.82 | CNR1 (0.59) | CNR1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL5796174 | 0.82 | CNR1 (0.54) | CNR1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL13114751 | 0.72 | CNR1 (0.49) | CNR1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL4806813 | 0.72 | CNR1 (0.73) | CNR1CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL13134239 | 0.72 | CNR1 (0.50) | CNR1CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL14180979 | 0.72 | CNR1 (0.62) | CNR1CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL13114674 | 0.72 | CNR1 (0.50) | CNR1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL3553773 | 0.71 | NOTUM (0.44) | CNR1CYP3A4CYP2C9CYP2C19MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1697371-A1 | AZABICYCLIC HETEROCYCLES AS CANNABINOID RECEPTOR MODULATORS | Bristol-Myers Squibb Company (US) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005063762-A1 | AZABICYCLIC HETEROCYCLES AS CANNABINOID RECEPTOR MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-07-14 | — | — | WO | disclosed |