Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 13/20 | 0.67 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | BRD1 | O95696 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | BRD2 | P25440 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5176300 | 0.89 | CHEK2 (0.64) | CHEK2SLC2A1KDM4ENPC1ALDH1A1 | |
| SCHEMBL3573611 | 0.86 | CHEK2 (0.85) | CHEK2 | |
| SCHEMBL5178047 | 0.83 | CHEK2 (0.69) | CHEK2BRD4BRD1PARP1BRD2 | |
| SCHEMBL3565309 | 0.83 | CHEK2 (0.71) | CHEK2KDM4ENPC1ALDH1A1PKM | |
| SCHEMBL5186686 | 0.83 | CHEK2 (0.64) | CHEK2SLC2A1 | |
| SCHEMBL5178273 | 0.83 | CHEK2 (0.61) | CHEK2SLC2A1 | |
| SCHEMBL5176736 | 0.81 | CHEK2 (0.67) | CHEK2BRD4BRD1PARP1BRD2 | |
| SCHEMBL5176765 | 0.81 | CHEK2 (0.61) | CHEK2SLC2A1 | |
| SCHEMBL5177162 | 0.80 | CHEK2 (0.63) | CHEK2SLC2A1HPSE | |
| SCHEMBL5250850 | 0.80 | CHEK2 (0.56) | CHEK2PARP1KDM4ENPC1ALDH1A1 |
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-1613313-B1 | 2-PHENYL-BENZIMIDAZOL AND 2-PHENYL-IMIDAZO-4,5]-PYRIDINE DERIVATIVES AS CHECKPOINT KINASE CDS1 (CHK2) INHIBITORS FOR THE TREATMENT OF CANCER | JANSSEN PHARMACEUTICA NV (BE) | 2007-06-06 | — | — | EP | claimed |