Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.59 |
| ▸ | RELA | Q04206 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | RARB | P10826 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10611954 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10613265 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10905823 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10609524 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10611097 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10611962 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10612610 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10613705 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10614179 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10614133 | 1.00 | NPC1 (0.59) | NPC1LMNANFKB1NFKB2RELA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0110299-B2 | SMECTIC LIQUID CRYSTAL COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS | HITACHI, LTD. (JP) | 1993-06-09 | — | — | EP | disclosed |
| EP-0110299-B1 | SMECTIC LIQUID CRYSTAL COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS | HITACHI, LTD. (JP) | 1988-06-29 | — | — | EP | disclosed |
| US-4576732-A | OPTICAL DISPLAYS | HITACHI, LTD. (JP) | 1986-03-18 | — | — | US | disclosed |
| EP-0110299-A2 | Smectic liquid crystal compounds and liquid crystal compositions | HITACHI, LTD. (JP) | 1984-06-13 | — | — | EP | disclosed |