Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.45 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.45 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.45 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.44 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11019650 | 0.92 | CHEK2 (0.43) | CHEK2KDM4EALDH1A1LMNAHTT | |
| SCHEMBL11017902 | 0.91 | CHEK2 (0.53) | CHEK2L3MBTL1HDAC6AMY1APDE4A | |
| SCHEMBL11016463 | 0.90 | CHEK2 (0.66) | CHEK2 | |
| SCHEMBL11019907 | 0.89 | CHEK2 (0.53) | CHEK2KDM4EALDH1A1LMNAHTT | |
| SCHEMBL11020867 | 0.84 | TP53 (0.51) | CHEK2KDM4EALDH1A1LMNAHTT | |
| SCHEMBL11017897 | 0.82 | PDE4A (0.44) | CHEK2L3MBTL1AMY1APDE4APDE4B | |
| SCHEMBL11016890 | 0.82 | CHEK2 (0.63) | CHEK2LMNA | |
| SCHEMBL11016458 | 0.82 | CHEK2 (0.55) | CHEK2 | |
| SCHEMBL11019275 | 0.81 | CHEK2 (0.48) | CHEK2KDM4ELMNAHDAC6PKN1 | |
| SCHEMBL10760161 | 0.80 | RHEB (0.47) | CHEK2KDM4EALDH1A1LMNAHTT |
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-0148431-A1 | Benzimidazoles, their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1985-07-17 | — | — | EP | disclosed |