Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
| ▸ | LPL | P06858 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10476041 | 0.81 | RARB (0.59) | CNR1CNR2RARBL3MBTL1PPARA | |
| SCHEMBL3557706 | 0.80 | RARB (0.43) | CNR1CNR2RARBSKP2PPARA | |
| SCHEMBL13424386 | 0.78 | PLK1 (0.44) | CNR1CNR2RARBSKP2L3MBTL1 | |
| SCHEMBL1363263 | 0.78 | CNR1 (0.44) | CNR1CNR2RARBSKP2L3MBTL1 | |
| SCHEMBL10659876 | 0.76 | ALDH1A1 (0.44) | CNR1CNR2SKP2L3MBTL1MCL1 | |
| SCHEMBL8876740 | 0.76 | PLK1 (0.43) | CNR1CNR2RARBSKP2L3MBTL1 | |
| SCHEMBL10885453 | 0.76 | PLK1 (0.43) | CNR1CNR2RARBSKP2L3MBTL1 | |
| SCHEMBL28783796 | 0.74 | L3MBTL1 (0.53) | CNR1CNR2RARBL3MBTL1LPL | |
| SCHEMBL15498466 | 0.74 | KDM4E (0.45) | RARBL3MBTL1PPARASORT1PLK1 | |
| SCHEMBL6892869 | 0.74 | SKP2 (0.57) | RARBSKP2PPARAPLK1PPARG |
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 |
|---|---|---|---|---|---|---|---|
| US-4571437-A | CATALYTIC HYDROGENATION REDUCTION AND REARRANGEMENT OF NITROBENZENE IN PRESENCE OF SULFUR COMPOUND | MALLINCKRODT, INC. (US) | 1986-02-18 | — | — | US | disclosed |