Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 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 | |
|---|---|---|---|---|
| SCHEMBL8938762 | 0.94 | ESR2 (0.34) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8938775 | 0.94 | ESR2 (0.34) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8938724 | 0.93 | ESR2 (0.36) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8938920 | 0.93 | ESR2 (0.33) | ESR2GABRA1GABRB2HTR2CHTR2B | |
| SCHEMBL8938793 | 0.93 | ESR2 (0.33) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8938791 | 0.93 | ESR2 (0.33) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8938778 | 0.93 | ESR2 (0.33) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8938783 | 0.93 | ESR2 (0.33) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8937450 | 0.92 | ESR2 (0.32) | ESR2GABRA1GABRB2HTR2CHTR2B | |
| SCHEMBL8938972 | 0.92 | ESR2 (0.33) | ESR2GABRA1GABRB2 |
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-8187494-B2 | Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2012-05-29 | — | — | US | disclosed |