Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624989 | 0.86 | MEN1 (0.54) | PIM1PIM2LTA4HKMT2APTGS2 | |
| SCHEMBL9625283 | 0.86 | CYP2D6 (0.53) | NPC1RAB9ASMN1; SMN2AHRLTA4H | |
| SCHEMBL9625001 | 0.83 | RARB (0.54) | TP53AHRLTA4HTSHR | |
| SCHEMBL9625314 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H | |
| SCHEMBL9625871 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H | |
| SCHEMBL9625953 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H | |
| SCHEMBL9625048 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H | |
| SCHEMBL9626059 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H | |
| SCHEMBL9625981 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H | |
| SCHEMBL9625437 | 0.82 | RARB (0.56) | NPC1RAB9AMAPTTP53LTA4H |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0325796-B1 | A LIQUID CRYSTAL COMPOUND AND A MIXTURE CONTAINING THE SAME | Chisso Corporation (JP) | 1992-03-11 | — | — | EP | disclosed |
| US-4877548-A | STABLE TO HEAT, LIGHT, ELECTRICITY AND MOISTURE | CHISSO CORPORATION (JP) | 1989-10-31 | — | — | US | disclosed |