Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 2/20 | 0.35 |
| ▸ | KDM1A | O60341 | 3/20 | 0.35 |
| ▸ | PHGDH | O43175 | 1/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.34 |
| ▸ | ITGAL | P20701 | 2/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.34 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18415693 | 0.88 | RAF1 (0.37) | GPR52CA2CA9RAF1KDM1A | |
| SCHEMBL17655412 | 0.84 | FGFR4 (0.46) | GPR52CA2CA9RAF1PHGDH | |
| SCHEMBL12654065 | 0.83 | TRPM8 (0.42) | CA2CA9KDM1APHGDHKMO | |
| SCHEMBL17655440 | 0.80 | MPL (0.44) | CA2CA9KDM1AKMOADORA2A | |
| SCHEMBL12654139 | 0.80 | L3MBTL1 (0.41) | CA2CA9KDM1AKMOKDR | |
| SCHEMBL1815134 | 0.78 | CA2 (0.44) | CA2CA9KDM1APHGDHKMO | |
| SCHEMBL17768071 | 0.78 | GPR52 (0.40) | GPR52CA2CA9FFAR4PHGDH | |
| SCHEMBL19706665 | 0.78 | GPR52 (0.40) | GPR52CA2CA9FFAR4PHGDH | |
| SCHEMBL12654104 | 0.78 | DDR1 (0.41) | CA2CA9KDM1AKDRMAOA | |
| SCHEMBL12654140 | 0.77 | KMO (0.39) | CA2CA9KDM1ATRPV3KMO |
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-2493888-B1 | BICYCLIC PYRIDINES AND ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2016-04-06 | — | — | EP | disclosed |