Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | NT5E | P21589 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 7/20 | 0.36 |
| ▸ | AHCY | P23526 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9684345 | 0.87 | CDK1 (0.41) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9184996 | 0.86 | CDK1 (0.49) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9685542 | 0.86 | CYP3A4 (0.45) | AHCYCYP3A4FGFR1SLC22A6 | |
| SCHEMBL9684414 | 0.82 | HPRT1 (0.56) | HPRT1 | |
| SCHEMBL9417147 | 0.80 | CYP3A4 (0.42) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9684339 | 0.78 | HPRT1 (0.45) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9857535 | 0.78 | CDK1 (0.40) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9858340 | 0.75 | HPRT1 (0.43) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9417176 | 0.74 | FGFR1 (0.51) | CDK1CCNB1CCNE1CDK2NT5E | |
| SCHEMBL9684215 | 0.73 | ADORA2A (0.40) | AHCYCYP3A4FGFR1SLC22A6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0374622-A2 | 3,4-Bis-(methylamino)-6-(2,3-dimethyl-2-butyl)-1,2,4-triazin-5(4H)-one, process for its preparation and its use as a herbicide | BAYER AG (DE) | 1990-06-27 | — | — | EP | claimed |
| US-5166198-A | Herpes virus infections | BEECHAM P.L.C. (GB) | 1992-11-24 | — | — | US | disclosed |
| EP-0404296-A1 | Phosphono derivatives of purine with antiviral activity | Beecham Group p.l.c. (GB) | 1990-12-27 | — | — | EP | disclosed |