Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.62 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.62 |
| ▸ | METAP2 | P50579 | 2/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | MARK3 | P27448 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10700605 | 0.89 | AURKA (0.50) | AURKAAURKBMETAP2ADORA2AADORA2B | |
| SCHEMBL10695284 | 0.86 | AURKA (0.44) | AURKAAURKBMETAP2ADORA2AADORA2B | |
| SCHEMBL10700349 | 0.85 | AURKA (0.62) | AURKAAURKBMETAP2CBFBMETAP1 | |
| SCHEMBL10700213 | 0.82 | AURKA (0.56) | AURKAAURKBPDE4APDE4BPDE4C | |
| SCHEMBL10696602 | 0.82 | AURKA (0.60) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL4945475 | 0.81 | AURKA (0.92) | AURKAAURKBMETAP2CHEK1SRC | |
| SCHEMBL10530542 | 0.81 | AURKA (0.49) | AURKAAURKBMETAP2ADORA2AADORA2B | |
| SCHEMBL4957006 | 0.80 | AURKA (0.66) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10699499 | 0.79 | AURKA (0.57) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10698026 | 0.78 | AURKA (0.58) | AURKAAURKBCHEK1SRCCDK2 |
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 |