Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 4/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | FLT4 | P35916 | 1/20 | 0.38 |
| ▸ | ABL2 | P42684 | 1/20 | 0.38 |
| ▸ | BLK | P51451 | 1/20 | 0.38 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 4/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.36 |
| ▸ | GAK | O14976 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13257077 | 0.92 | KCNK3 (0.40) | AURKAAURKBBRAFKCNK3KCNK9 | |
| SCHEMBL17787698 | 0.90 | PARP1 (0.42) | BRAFTAAR1MAPK14KCNK3KCNK9 | |
| SCHEMBL12662463 | 0.90 | PARP1 (0.42) | BRAFTAAR1MAPK14KCNK3KCNK9 | |
| SCHEMBL17787683 | 0.84 | PARP1 (0.42) | BRAFMAPK14KCNK3KCNK9 | |
| SCHEMBL12662088 | 0.84 | PARP1 (0.42) | BRAFMAPK14KCNK3KCNK9 | |
| SCHEMBL17787712 | 0.83 | P2RX1 (0.42) | BRAFKCNK3KCNK9 | |
| SCHEMBL12662087 | 0.83 | P2RX1 (0.42) | BRAFKCNK3KCNK9 | |
| SCHEMBL1895828 | 0.82 | PARP1 (0.52) | KCNK3KCNK9 | |
| SCHEMBL1895829 | 0.82 | PARP1 (0.52) | KCNK3KCNK9 | |
| SCHEMBL12662539 | 0.80 | P2RX1 (0.40) | BRAFTAAR1PRMT5WDR77 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010088574-A1 | AZABENZIMIDAZOLES AND RELATED ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2010-08-05 | — | — | WO | disclosed |