Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.49 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | CCND1 | P24385 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 6/20 | 0.38 |
| ▸ | KCNJ5 | P48544 | 6/20 | 0.38 |
| ▸ | KCNJ3 | P48549 | 6/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10700213 | 0.82 | AURKA (0.56) | AURKAAURKBKITALDH1A1MAPT | |
| SCHEMBL13341241 | 0.80 | HDAC1 (0.46) | KCNA5KCNJ5KCNJ3ALDH1A1MEN1 | |
| SCHEMBL10701181 | 0.79 | AURKA (0.48) | AURKAAURKBCDK2CDK4CCND1 | |
| SCHEMBL9833102 | 0.79 | PDE4A (0.49) | AURKAAURKBCDK2CCNB2CCNE2 | |
| SCHEMBL10700525 | 0.77 | AURKA (0.61) | AURKAAURKBCDK2BRD4CHEK1 | |
| SCHEMBL10695665 | 0.77 | RIPK1 (0.48) | AURKAAURKBGAAMAPTKMT2A | |
| SCHEMBL3424599 | 0.76 | HDAC1 (0.41) | AURKAAURKBKCNA5KCNJ5KCNJ3 | |
| SCHEMBL13341644 | 0.75 | AURKA (0.37) | AURKAAURKBALDH1A1MARK3MEN1 | |
| SCHEMBL13341658 | 0.75 | PDE9A (0.41) | AURKAAURKBKCNA5KCNJ5KCNJ3 | |
| SCHEMBL10696602 | 0.75 | AURKA (0.60) | AURKAAURKBCDK2BRD4CHEK1 |
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 |