Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.32 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.31 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.31 |
| ▸ | LPL | P06858 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.31 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.31 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28398709 | 0.67 | CNR1 (0.42) | CNR1CNR2THRBSORT1METAP2 | |
| SCHEMBL19192515 | 0.67 | VDR (0.46) | CNR1CNR2THRBVDR | |
| SCHEMBL14446719 | 0.67 | HTT (0.38) | CYP2D6CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL18007124 | 0.67 | CNR1 (0.48) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL26311628 | 0.66 | ALDH1A1 (0.31) | CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL598650 | 0.65 | CNR1 (0.50) | CNR1CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL26311730 | 0.65 | PRSS1 (0.34) | — | |
| SCHEMBL1069410 | 0.64 | CNR1 (0.45) | CNR1CNR2THRBCYP3A4CYP2D6 | |
| SCHEMBL1005261 | 0.64 | CNR1 (0.61) | CNR1CNR2CYP3A4CYP2D6ALOX5 | |
| SCHEMBL5165125 | 0.64 | CNR1 (0.55) | CNR1CNR2CYP3A4CYP2D6CYP2C9 |
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-1556358-B1 | ENANTIOSELECTIVE ALKYLATION OF TRICYCLIC COMPOUNDS | SCHERING CORP (US) | 2007-06-20 | — | — | EP | disclosed |