Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 2/20 | 0.37 |
| ▸ | P2RY14 | Q15391 | 3/20 | 0.36 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18458536 | 0.95 | ESR2 (0.47) | ESR2NPC1RAB9AAPPP2RY14 | |
| SCHEMBL28574546 | 0.91 | NPC1 (0.42) | ESR2NPC1RAB9AAPPP2RY14 | |
| SCHEMBL17210747 | 0.91 | NPC1 (0.42) | ESR2NPC1RAB9AAPPP2RY14 | |
| SCHEMBL19619403 | 0.87 | ESR2 (0.46) | ESR2NPC1RAB9AAPPPRKAB2 | |
| SCHEMBL13628948 | 0.86 | ESR2 (0.52) | ESR2CYP3A4CYP2C9KDM1AESR1 | |
| SCHEMBL18385877 | 0.86 | NPC1 (0.39) | ESR2NPC1RAB9AAPPP2RY14 | |
| SCHEMBL18385879 | 0.86 | NPC1 (0.39) | ESR2NPC1RAB9AAPPP2RY14 | |
| SCHEMBL28572205 | 0.84 | HSP90AA1 (0.44) | ESR2NPC1RAB9AAPPCYP3A4 | |
| SCHEMBL28538282 | 0.84 | HSP90AA1 (0.40) | ESR2NPC1RAB9AAPPP2RY14 | |
| SCHEMBL18458554 | 0.83 | ESR2 (0.37) | ESR2NPC1RAB9AAPPP2RY14 |
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-7425354-B2 | Photopolymerizable liquid crystal composition, its polymer or polymer composition, and optical compensation element | CHISSO CORPORATION (JP) | 2008-09-16 | — | — | US | disclosed |