Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADA | P00813 | 5/20 | 0.43 |
| ▸ | AMPD3 | Q01432 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | AHCY | P23526 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10448915 | 0.82 | AHCY (0.45) | ADAAHCYADORA2BADORA3 | |
| SCHEMBL9690886 | 0.82 | AHCY (0.45) | ADAAHCYADORA2BADORA3 | |
| Coformycin SCHEMBL442534 | 0.78 | ADA (0.68) | ADAAMPD3GAAADORA3ADORA1 | |
| Coformycin SCHEMBL8373037 | 0.78 | ADA (0.68) | ADAAMPD3GAAADORA3ADORA1 | |
| Coformycin SCHEMBL13697497 | 0.78 | ADA (0.68) | ADAAMPD3GAAADORA3ADORA1 | |
| Coformycin SCHEMBL13697294 | 0.78 | ADA (0.68) | ADAAMPD3GAAADORA3ADORA1 | |
| Coformycin SCHEMBL7796895 | 0.78 | ADA (0.68) | ADAAMPD3GAAADORA3ADORA1 | |
| SCHEMBL10792647 | 0.73 | ADA (0.55) | ADAAMPD3GAAADORA3ADORA2A | |
| SCHEMBL7790217 | 0.73 | ADA (0.55) | ADAAMPD3GAAADORA3ADORA2A | |
| SCHEMBL8371414 | 0.73 | ADA (0.55) | ADAAMPD3GAAADORA3ADORA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5089045-A | Substituted 3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepine-8-ol herbicides | SCHERING AGROCHEMICALS LIMITED (GB) | 1992-02-18 | — | — | US | disclosed |
| EP-0398514-A1 | Diazepine herbicides | SCHERING AGROCHEMICALS LIMITED (GB) | 1990-11-22 | — | — | EP | disclosed |