Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14525912 | 0.86 | ALDH1A1 (0.46) | ALDH1A1MAPK1HPGDNPC1RAB9A | |
| SCHEMBL16373432 | 0.84 | ALDH1A1 (0.48) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12334415 | 0.84 | ALDH1A1 (0.48) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5467699 | 0.84 | CYP2A6 (0.42) | ALDH1A1MAPK1HPGDNPC1RAB9A | |
| SCHEMBL11982037 | 0.77 | — | — | |
| SCHEMBL14615792 | 0.75 | ALDH1A1 (0.37) | ALDH1A1MAPK1HPGDNPC1RAB9A | |
| SCHEMBL14299861 | 0.70 | CYP2A6 (0.36) | ALDH1A1 | |
| SCHEMBL12164046 | 0.66 | RAB9A (0.50) | ALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL1673427 | 0.64 | ALDH1A1 (0.73) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL68094 | 0.64 | ALDH1A1 (0.73) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1687856-B1 | ELECTROLUMINESCENT DEVICES COMPRISING 2-(P-TRIPHENYL)-3-PHENYL-PYRAZINE DERIVATIVES | CIBA SC HOLDING AG (CH) | 2007-02-28 | — | — | EP | disclosed |