Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.32 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18548350 | 0.88 | GBA1 (0.39) | RAB9ANPC1ALDH1A1KDM4EGBA1 | |
| SCHEMBL21284379 | 0.81 | GABRA5 (0.44) | RAB9ANPC1ALDH1A1KDM4EGBA1 | |
| SCHEMBL21274352 | 0.81 | GABRA5 (0.44) | RAB9ANPC1ALDH1A1KDM4EGBA1 | |
| SCHEMBL21284378 | 0.81 | GABRA5 (0.44) | RAB9ANPC1ALDH1A1KDM4EGBA1 | |
| SCHEMBL9286052 | 0.80 | CYP3A4 (0.43) | ALDH1A1KDM4ECYP3A4CYP2D6L3MBTL1 | |
| SCHEMBL29193311 | 0.79 | ALDH1A1 (0.49) | ALDH1A1KDM4EL3MBTL1SLC2A1GABRA5 | |
| SCHEMBL29193309 | 0.79 | ALDH1A1 (0.49) | ALDH1A1KDM4EL3MBTL1SLC2A1GABRA5 | |
| SCHEMBL9730406 | 0.78 | MAPT (0.55) | ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL9141569 | 0.78 | MAPT (0.55) | ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL9699977 | 0.78 | CYP3A4 (0.51) | RAB9ANPC1KDM4EGBA1CYP3A4 |
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-0639189-B1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | AVENTIS RES & TECH GMBH & CO (DE) | 2003-02-19 | — | — | EP | disclosed |
| WO-1992012974-A1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-08-06 | — | — | WO | disclosed |