Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | GPR6 | P46095 | 1/20 | 0.32 |
| ▸ | BCL3 | P20749 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8306105 | 0.88 | PKM (0.40) | CCR8KCNH2MAPTTSHRSMN1; SMN2 | |
| SCHEMBL8305625 | 0.86 | GAA (0.40) | MAPTTSHRSMN1; SMN2BCL3POLB | |
| SCHEMBL8300908 | 0.85 | MAPT (0.36) | PARP1MCHR1MAPTTSHRNPC1 | |
| SCHEMBL8305570 | 0.84 | CNR2 (0.39) | KCNH2BCL3 | |
| SCHEMBL8302364 | 0.82 | HIF1A (0.47) | MCHR1MAPTSMN1; SMN2AURKACDK1 | |
| SCHEMBL8302374 | 0.81 | KDM4E (0.34) | MCHR1AURKACDK1CCNB1CDK2 | |
| SCHEMBL12252752 | 0.81 | AURKA (0.45) | PARP1NPC1RAB9ASMN1; SMN2AURKA | |
| SCHEMBL14311682 | 0.79 | AURKA (0.43) | MCHR1TSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12027127 | 0.79 | ADORA3 (0.35) | MCHR1NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL8299878 | 0.78 | NPC1 (0.42) | MCHR1MAPTNPC1RAB9ASMN1; SMN2 |
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 |