Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKN1 | Q16512 | 3/20 | 0.63 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.63 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SCD | O00767 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10575366 | 0.90 | PKN1 (0.53) | PKN1PKN2CHEK2KDM4EALDH1A1 | |
| SCHEMBL10574957 | 0.85 | CHEK2 (0.65) | CHEK2KDM4EALDH1A1GAAHPGD | |
| SCHEMBL13672566 | 0.83 | NPC1 (0.66) | PKN1PKN2KDM4EALDH1A1GAA | |
| SCHEMBL10573947 | 0.80 | NPC1 (0.58) | PKN1PKN2KDM4EALDH1A1GAA | |
| SCHEMBL10574986 | 0.78 | PKN1 (0.63) | PKN1PKN2KDM4EALDH1A1GAA | |
| SCHEMBL10578768 | 0.78 | ALDH1A1 (0.60) | PKN1PKN2CHEK2KDM4EALDH1A1 | |
| SCHEMBL10577766 | 0.77 | NPC1 (0.54) | PKN1PKN2KDM4EALDH1A1GAA | |
| SCHEMBL10579087 | 0.76 | KDM4E (0.52) | PKN1PKN2CHEK2KDM4EALDH1A1 | |
| Ridinilazole SCHEMBL29785777 | 0.76 | NPC1 (0.73) | PKN1PKN2CHEK2KDM4EALDH1A1 | |
| Ridinilazole SCHEMBL29613225 | 0.76 | NPC1 (0.73) | PKN1PKN2CHEK2KDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4882342-A | CARDIOVASCULAR DISORDERS | BOEHRINGER MANNHEIM GMBH (DE) | 1989-11-21 | — | — | US | claimed |
| US-4882342-A | CARDIOVASCULAR DISORDERS | BOEHRINGER MANNHEIM GMBH (DE) | 1989-11-21 | — | — | US | disclosed |
| EP-0266558-A2 | 5-Alkylbenzimidazoles, process for their preparation and medicaments containing them | Roche Diagnostics GmbH (DE) | 1988-05-11 | — | — | EP | disclosed |