Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 6/20 | 0.47 |
| ▸ | EPAS1 | Q99814 | 6/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL8305570 | 0.85 | CNR2 (0.39) | — | |
| SCHEMBL8305625 | 0.82 | GAA (0.40) | CD274MAPTSTAT3SMN1; SMN2POLB | |
| SCHEMBL8302374 | 0.82 | KDM4E (0.34) | MCHR1AURKACDK1CCNB1CDK2 | |
| SCHEMBL8305595 | 0.82 | PARP1 (0.34) | MCHR1CD274AURKACDK1CCNB1 | |
| SCHEMBL8299902 | 0.81 | ABL1 (0.38) | CD274AURKAALDH1A1 | |
| SCHEMBL14311682 | 0.81 | AURKA (0.43) | MCHR1EPHX2AURKACDK1CCNB1 | |
| SCHEMBL16471209 | 0.81 | MAPK14 (0.39) | MCHR1MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8300908 | 0.80 | MAPT (0.36) | MCHR1CD274AURKACDK1CCNB1 | |
| SCHEMBL8299908 | 0.79 | MCHR1 (0.32) | MCHR1AURKACDK1CCNB1CDK2 | |
| SCHEMBL12304187 | 0.79 | AURKA (0.53) | HIF1AEPAS1AURKACDK1CCNB1 |
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 |