Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 16/20 | 0.96 |
| ▸ | DHODH | Q02127 | 3/20 | 0.96 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.65 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.65 |
| ▸ | LCK | P06239 | 1/20 | 0.65 |
| ▸ | CSF1R | P07333 | 1/20 | 0.65 |
| ▸ | PIM1 | P11309 | 1/20 | 0.65 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.65 |
| ▸ | MARK3 | P27448 | 1/20 | 0.65 |
| ▸ | KDR | P35968 | 1/20 | 0.65 |
| ▸ | FLT3 | P36888 | 1/20 | 0.65 |
| ▸ | CLK2 | P49760 | 1/20 | 0.65 |
| ▸ | GSK3A | P49840 | 1/20 | 0.65 |
| ▸ | ITK | Q08881 | 1/20 | 0.65 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.65 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.65 |
| ▸ | MARK2 | Q7KZI7 | 1/20 | 0.65 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.65 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.65 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL6810415 | 0.87 | PARP1 (0.77) | PARP1DHODHPIM1KDRFLT3 | |
| Hydrochloric Acid SCHEMBL3580669 | 0.87 | PARP1 (0.81) | PARP1DHODHCHEK1MAP4K4LCK | |
| SCHEMBL6582801 | 0.86 | PARP1 (0.73) | PARP1DHODHCHEK1MAP4K4LCK | |
| SCHEMBL3578489 | 0.85 | PARP1 (0.71) | PARP1DHODHCHEK1AURKBCHEK2 | |
| SCHEMBL7135390 | 0.84 | PARP1 (0.81) | PARP1DHODHPIM1KDRFLT3 | |
| SCHEMBL18241702 | 0.83 | PARP1 (1.00) | PARP1DHODHCHEK1MAP4K4LCK | |
| SCHEMBL6800853 | 0.82 | PARP1 (0.70) | PARP1DHODHPIM1KDRFLT3 | |
| SCHEMBL7137128 | 0.82 | PARP1 (1.00) | PARP1DHODHKDRAURKB | |
| SCHEMBL7139308 | 0.81 | PARP1 (1.00) | PARP1DHODHKDRAURKB | |
| SCHEMBL16366311 | 0.81 | PARP1 (0.76) | PARP1DHODHCHEK1MAP4K4LCK |
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-7781596-B1 | Substituted 2-phenylbenzimidazoles, the production thereof and their use | ABBOTT LABORATORIES (US) | 2010-08-24 | — | — | US | disclosed |