Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.52 |
| ▸ | DHODH | Q02127 | 1/20 | 0.52 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.48 |
| ▸ | PIM1 | P11309 | 2/20 | 0.48 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.48 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.48 |
| ▸ | BRSK1 | Q8TDC3 | 1/20 | 0.48 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 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 | |
|---|---|---|---|---|
| SCHEMBL6810748 | 0.87 | AURKB (0.52) | PARP1DHODHAURKBPIM1PIM3 | |
| SCHEMBL6800853 | 0.85 | PARP1 (0.70) | PARP1DHODHAURKBPIM1PIM3 | |
| SCHEMBL6810424 | 0.85 | PARP1 (0.57) | PARP1DHODHAURKBCHEK2ACHE | |
| SCHEMBL3578489 | 0.82 | PARP1 (0.71) | PARP1DHODHAURKBCHEK2ACHE | |
| SCHEMBL6806081 | 0.80 | PIM1 (0.51) | PARP1AURKBPIM1PIM3MKNK2 | |
| SCHEMBL6810662 | 0.79 | PARP1 (0.49) | PARP1DHODHAURKBPIM1PIM3 | |
| SCHEMBL6806572 | 0.79 | PIM1 (0.74) | PARP1DHODHAURKBPIM1PIM3 | |
| SCHEMBL6805290 | 0.79 | PIM1 (0.50) | PARP1AURKBPIM1PIM3MKNK2 | |
| SCHEMBL6806306 | 0.78 | PARP1 (0.47) | PARP1DHODHAURKBPIM1PIM3 | |
| SCHEMBL6587825 | 0.76 | PARP1 (0.54) | PARP1DHODHAURKBPIM1PIM3 |
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 |