Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | PPARD | Q03181 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6505714 | 0.90 | NPC1 (0.41) | ADORA2AADORA1ADORA3ADORA2BALDH1A1 | |
| SCHEMBL6496502 | 0.86 | PPARA (0.39) | ALDH1A1PPARGPPARDPPARAMAPT | |
| SCHEMBL6505578 | 0.84 | PPARG (0.41) | PPARGPPARDPPARA | |
| SCHEMBL6503008 | 0.83 | PPARG (0.48) | PPARGPPARDPPARA | |
| SCHEMBL6506146 | 0.81 | EPHX2 (0.37) | PPARGPPARDPPARA | |
| Trifluoroacetic Acid SCHEMBL6505587 | 0.81 | PPARA (0.38) | ADORA2AADORA1ALDH1A1PPARGPPARD | |
| SCHEMBL6495630 | 0.80 | PPARA (0.38) | ALDH1A1PPARGPPARDPPARAMAPT | |
| SCHEMBL6496468 | 0.79 | MAPT (0.38) | ADORA2AADORA1ALDH1A1PPARGPPARD | |
| SCHEMBL7684246 | 0.79 | SHMT1 (0.39) | KDM4EPPARGPPARDPPARAMAPT | |
| SCHEMBL6496963 | 0.78 | TP53 (0.39) | ADORA2AADORA1ADORA3ADORA2BALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6884821-B1 | Carboxylic acid derivatives and drugs containing the same | EISAI CO., LTD. (JP) | 2005-04-26 | — | — | US | disclosed |
| EP-1216980-A1 | CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME | Eisai Co., Ltd. (JP) | 2002-06-26 | — | — | EP | disclosed |