Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 9/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4758323 | 1.00 | IDO1 (0.40) | IDO1AGXTMAOBALKBH1CCR5 | |
| SCHEMBL510480 | 0.81 | IDO1 (0.38) | IDO1AGXTMAOBALKBH1CCR5 | |
| SCHEMBL510479 | 0.81 | IDO1 (0.38) | IDO1AGXTMAOBALKBH1CCR5 | |
| SCHEMBL4757964 | 0.75 | EGLN1 (0.42) | MAOB | |
| SCHEMBL4757966 | 0.75 | EGLN1 (0.42) | MAOB | |
| SCHEMBL2942352 | 0.69 | NPC1 (0.38) | AGXTMAOB | |
| SCHEMBL2942355 | 0.69 | NPC1 (0.38) | AGXTMAOB | |
| SCHEMBL29975341 | 0.68 | GRM5 (0.53) | IDO1AGXTMAOBMAPK14 | |
| SCHEMBL28678965 | 0.67 | MIF (0.42) | IDO1AGXT | |
| SCHEMBL1711843 | 0.66 | IDO1 (0.47) | IDO1AGXTMAOBALKBH1GSK3B |
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-1944303-B1 | PYRIDINE DERIVATIVE SUBSTITUTED BY HETEROCYCLE AND FUNGICIDE CONTAINING THE SAME | EISAI R&D MAN CO LTD (JP) | 2013-08-21 | — | — | EP | disclosed |
| EP-1944303-A1 | PYRIDINE DERIVATIVE SUBSTITUTED BY HETEROCYCLE AND FUNGICIDE CONTAINING THE SAME | Eisai R&D Management Co., Ltd. (JP) | 2008-07-16 | — | — | EP | disclosed |