Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.36 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.34 |
| ▸ | AURKA | O14965 | 2/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CCKBR | P32239 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8305595 | 0.85 | PARP1 (0.34) | MAPTPDCD1CD274AURKAAURKB | |
| SCHEMBL8305625 | 0.84 | GAA (0.40) | MAPTPDCD1CD274TSHRSMN1; SMN2 | |
| SCHEMBL8305570 | 0.83 | CNR2 (0.39) | — | |
| SCHEMBL8306105 | 0.82 | PKM (0.40) | MAPTIRAK4LMNATSHRSMN1; SMN2 | |
| SCHEMBL8305065 | 0.81 | AURKA (0.45) | MAPTHSD17B10IRAK4FGFR3AURKA | |
| SCHEMBL8302364 | 0.80 | HIF1A (0.47) | MAPTCD274AURKAAURKBCDK1 | |
| SCHEMBL8302374 | 0.78 | KDM4E (0.34) | HSD17B10AURKAAURKBCDK1CCNB1 | |
| SCHEMBL14311682 | 0.78 | AURKA (0.43) | HSD17B10FGFR3AURKAAURKBCDK1 | |
| SCHEMBL8299878 | 0.77 | NPC1 (0.42) | MAPTAURKAAURKBCDK1CCNB1 | |
| SCHEMBL8299902 | 0.77 | ABL1 (0.38) | FGFR3PDCD1CD274AURKAJAK2 |
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-2005002552-A2 | BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS PROTEIN KINASES INHIBITORS | ASTEX THERAPEUTICS LIMITED (GB) | 2005-01-13 | — | — | WO | disclosed |