Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.53 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | PARP1 | P09874 | 6/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.43 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.42 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | PRKCA | P17252 | 1/20 | 0.41 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.41 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6812407 | 0.96 | AURKA (0.50) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6805914 | 0.92 | AURKA (0.55) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6806391 | 0.91 | AURKA (0.54) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6809975 | 0.91 | AURKA (0.54) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6806351 | 0.89 | AURKA (0.59) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6802984 | 0.89 | JAK2 (0.53) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6805042 | 0.88 | AURKA (0.57) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6810290 | 0.86 | AURKA (0.54) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6805101 | 0.86 | AURKA (0.64) | AURKAAURKBKDRPARP1KCNH2 | |
| SCHEMBL6810130 | 0.85 | AURKA (0.54) | AURKAAURKBKDRPARP1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |