Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 12/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3575508 | 0.86 | CHEK2 (0.62) | CHEK2CYP3A4CYP2D6MAPTCYP2C19 | |
| SCHEMBL5253625 | 0.85 | CHEK2 (0.69) | CHEK2CYP3A4CYP2D6MAPTCYP2C19 | |
| SCHEMBL5178035 | 0.84 | CHEK2 (0.67) | CHEK2CYP3A4CYP2D6MAPTCYP2C19 | |
| SCHEMBL5177618 | 0.83 | CHEK2 (0.51) | CHEK2MEN1KMT2A | |
| SCHEMBL5177920 | 0.82 | CHEK2 (0.66) | CHEK2CYP3A4CYP2D6MAPTCYP2C19 | |
| SCHEMBL1382147 | 0.80 | CHEK2 (0.73) | CHEK2SIRT2SIRT1SIRT3 | |
| SCHEMBL5254723 | 0.79 | CHEK2 (0.67) | CHEK2MEN1KMT2APARP1 | |
| SCHEMBL5178851 | 0.78 | CHEK2 (0.67) | CHEK2CYP3A4CYP2D6MAPTCYP2C19 | |
| SCHEMBL5176577 | 0.77 | CHEK2 (0.66) | CHEK2MAPTKDM4EMEN1KMT2A | |
| SCHEMBL5178365 | 0.77 | CHEK2 (0.67) | CHEK2CYP3A4CYP2D6MAPTCYP2C19 |
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 |