Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.54 |
| ▸ | RORC | P51449 | 2/20 | 0.42 |
| ▸ | RORB | Q92753 | 2/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | EIF4E | P06730 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.39 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.39 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.39 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.39 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27635465 | 0.86 | BCAT2 (0.47) | BCAT2RORCRORBSCN9APDK2 | |
| SCHEMBL27635470 | 0.80 | BCAT2 (0.63) | BCAT2RORCRORBSCN9APDK2 | |
| SCHEMBL27656527 | 0.79 | AR (0.51) | BCAT2RORCRORBSCN9APDK2 | |
| SCHEMBL30608075 | 0.75 | PARP1 (0.56) | BCAT2SCN9APDK2PARP1KDM4E | |
| SCHEMBL5143960 | 0.75 | PARP1 (0.56) | BCAT2SCN9APDK2PARP1KDM4E | |
| SCHEMBL27635469 | 0.74 | BCAT2 (0.62) | BCAT2SCN9APDK2PARP1ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL31255509 | 0.74 | BCAT2 (0.79) | BCAT2PDK2PARP1NPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL1786045 | 0.74 | BCAT2 (0.79) | BCAT2PDK2PARP1NPC1RAB9A | |
| SCHEMBL28856804 | 0.73 | BCAT2 (0.45) | BCAT2SCN9APDK2EIF4EPARP1 | |
| SCHEMBL2935188 | 0.73 | BCAT2 (0.84) | BCAT2PARP1NPC1RAB9AIKBKB |
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 |
|---|---|---|---|---|---|---|---|
| CN-102793692-A | Compounds for inflammation and immune-related uses | SYNTA PHARMACEUTICALS CORP | 2012-11-28 | — | — | CN | claimed |
| CN-1826120-A | Compounds for inflammation and immune-related uses | SYNTA PHARMACEUTICALS CORP (US) | 2006-08-30 | — | — | CN | claimed |