Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10697316 | 0.86 | AURKA (0.37) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10698153 | 0.83 | AURKA (0.38) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10700376 | 0.80 | AURKA (0.42) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10698519 | 0.79 | CNR1 (0.41) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10696613 | 0.79 | AURKA (0.40) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10700532 | 0.79 | AURKA (0.43) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10699045 | 0.77 | GAA (0.42) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10697456 | 0.77 | MEN1 (0.40) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10701079 | 0.77 | AURKA (0.39) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10701198 | 0.77 | TNKS2 (0.44) | AURKAAURKBALDH1A1LMNA |
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 |