Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.58 |
| ▸ | SCD | O00767 | 11/20 | 0.47 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | FADS1 | O60427 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10695285 | 0.89 | AURKA (0.47) | AURKAAURKBSCDNPBWR1CYP3A4 | |
| SCHEMBL10698507 | 0.86 | AURKB (0.59) | AURKAAURKBSCDNPBWR1 | |
| SCHEMBL10698143 | 0.86 | AURKA (0.59) | AURKAAURKBNPBWR1CYP3A4 | |
| SCHEMBL13341261 | 0.86 | AURKA (0.52) | AURKAAURKBSCDNPBWR1CYP3A4 | |
| SCHEMBL10700799 | 0.86 | AURKA (0.56) | AURKAAURKBNPBWR1 | |
| SCHEMBL10696315 | 0.86 | AURKA (0.56) | AURKAAURKBSCDNPBWR1CYP3A4 | |
| SCHEMBL10696602 | 0.85 | AURKA (0.60) | AURKAAURKBSCDCYP3A4CYP2D6 | |
| SCHEMBL10701197 | 0.84 | AURKA (0.57) | AURKAAURKBNPBWR1 | |
| SCHEMBL10699037 | 0.84 | AURKA (0.57) | AURKAAURKBNPBWR1CYP3A4CYP2D6 | |
| SCHEMBL10697452 | 0.84 | AURKB (0.57) | AURKAAURKBNPBWR1CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0268178-A1 | Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-05-25 | — | — | EP | disclosed |