Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.31 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.31 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.31 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8936099 | 1.00 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936062 | 1.00 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936206 | 1.00 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936142 | 0.99 | ESR2 (0.33) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936250 | 0.96 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936383 | 0.96 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936388 | 0.96 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936390 | 0.96 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936414 | 0.96 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 | |
| SCHEMBL8936255 | 0.96 | RARB (0.34) | RARBESR2PDE5AHDAC1HDAC6 |
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 |