Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.39 |
| ▸ | ACR | P10323 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9239149 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7789217 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7798766 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7796053 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7797623 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7789247 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7797614 | 0.96 | ALDH1A1 (0.46) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7797626 | 0.92 | ALDH1A1 (0.43) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL7796057 | 0.92 | KMT2A (0.41) | ALDH1A1NPC1LMNANFKB1NFKB2 | |
| SCHEMBL8861897 | 0.92 | KMT2A (0.41) | ALDH1A1NPC1LMNANFKB1NFKB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0829469-B1 | Racemic compound and anti-ferroelectric liquid crystal composition | MITSUBISHI GAS CHEMICAL CO (JP) | 2001-12-05 | — | — | EP | disclosed |
| US-5951914-A | Racemic compound and anti-ferroelectric liquid crystal composition | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1999-09-14 | — | — | US | disclosed |
| EP-0829469-A2 | Racemic compound and anti-ferroelectric liquid crystal composition | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1998-03-18 | — | — | EP | disclosed |