Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.38 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.34 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.34 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.34 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.34 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.34 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.34 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.34 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.34 |
| ▸ | GRIK4 | Q16099 | 1/20 | 0.34 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.34 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | MGAM | O43451 | 2/20 | 0.33 |
| ▸ | SI | P14410 | 2/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6806378 | 0.87 | PARP1 (0.57) | PARP1CHEK2PKN1PKN2 | |
| SCHEMBL7480129 | 0.83 | MGAM (0.52) | PARP1PKN1PKN2NPBWR1HPSE | |
| SCHEMBL6587289 | 0.82 | PARP1 (0.49) | PARP1CHEK2PKN1PKN2HPSE | |
| SCHEMBL6588648 | 0.81 | PARP1 (0.40) | PARP1CHEK2PKN1PKN2HPSE | |
| SCHEMBL6806385 | 0.77 | CHEK2 (0.40) | PARP1CHEK2NPBWR1GRIK1GRIA1 | |
| SCHEMBL6587399 | 0.75 | HPSE (0.42) | PARP1HPSEGAAMGAMSI | |
| SCHEMBL6591184 | 0.74 | AURKB (0.44) | PARP1CHEK2PKN1PKN2HPSE | |
| SCHEMBL6586096 | 0.73 | PARP1 (0.53) | PARP1CHEK2PKN1PKN2HPSE | |
| SCHEMBL6588713 | 0.71 | HPSE (0.43) | PARP1CHEK2PKN1PKN2HPSE | |
| SCHEMBL6591596 | 0.70 | PARP1 (0.48) | PARP1CHEK2PKN1PKN2HPSE |
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-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |