Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL12603798 | 0.82 | PTGS1 (0.44) | NPC1ALDH1A1LMNAMAPTMAPK1 | |
| SCHEMBL20286644 | 0.79 | FFAR4 (0.38) | MMP2MMP3PDE2APPARAPDK2 | |
| SCHEMBL20286643 | 0.78 | ESR2 (0.43) | NPC1MAPTRAB9AESR1ESR2 | |
| SCHEMBL14371121 | 0.77 | PTGS2 (0.41) | S1PR1S1PR3PTGS1PTGS2 | |
| SCHEMBL21558709 | 0.77 | S1PR1 (0.43) | ESR1ESR2RARBMMP2MMP3 | |
| SCHEMBL12603788 | 0.75 | SLC1A3 (0.41) | NPC1ALDH1A1LMNAMAPTMAPK1 | |
| SCHEMBL12603787 | 0.75 | PPARA (0.50) | ALDH1A1MAPTAKR1C3AKR1C2PPARA | |
| SCHEMBL17295140 | 0.74 | PTGS2 (0.41) | LMNAESR1ESR2PDE2ATRPA1 | |
| SCHEMBL12603795 | 0.74 | PTGS1 (0.43) | NPC1ALDH1A1LMNAMAPTMAPK1 | |
| SCHEMBL10520096 | 0.74 | ESR2 (0.55) | NPC1ALDH1A1LMNAMAPTMAPK1 |
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-20180171234-A1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME | DIC CORPORATION (JP) | 2018-06-21 | — | — | US | disclosed |