Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 3/20 | 0.36 |
| ▸ | SCN8A | Q9UQD0 | 4/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 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 | |
|---|---|---|---|---|
| SCHEMBL1974222 | 0.81 | PARP1 (0.45) | PARP1CNR2SCN8ASCN10ACYP1A2 | |
| SCHEMBL2170923 | 0.78 | PARP1 (0.42) | PARP1CNR2SCN8ASCN10ACYP1A2 | |
| SCHEMBL2170203 | 0.78 | PARP1 (0.41) | PARP1SCN8ASCN10ACYP1A2CYP2C19 | |
| SCHEMBL2171056 | 0.69 | CNR2 (0.58) | CNR2 | |
| SCHEMBL2171041 | 0.69 | CNR2 (0.58) | CNR2 | |
| SCHEMBL2170874 | 0.69 | CNR2 (0.48) | PARP1CNR2CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL2170878 | 0.69 | CNR2 (0.48) | PARP1CNR2CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL4639880 | 0.68 | CYP1A2 (0.50) | SCN8ASCN10ACYP1A2CYP2C19CYP2C9 | |
| SCHEMBL3711919 | 0.67 | MRGPRX4 (0.44) | PARP1SCN8ASCN10ACYP1A2CYP2C19 | |
| SCHEMBL2171083 | 0.67 | PARP1 (0.38) | PARP1CNR2SCN8ASCN10AMRGPRX4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2346843-A2 | SUBSTITUTED BENZAMIDES AS CANNABINOID RECEPTOR LIGANDS | Abbott Laboratories (US) | 2011-07-27 | — | — | EP | claimed |
| WO-2010028338-A2 | NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS | ABBOTT LABORATORIES (US) | 2010-03-11 | — | — | WO | claimed |
| EP-2346843-A2 | SUBSTITUTED BENZAMIDES AS CANNABINOID RECEPTOR LIGANDS | Abbott Laboratories (US) | 2011-07-27 | — | — | EP | disclosed |
| WO-2010028338-A2 | NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS | ABBOTT LABORATORIES (US) | 2010-03-11 | — | — | WO | disclosed |