Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.66 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.66 |
| ▸ | CDK1 | P06493 | 1/20 | 0.55 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.55 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.55 |
| ▸ | CDK2 | P24941 | 1/20 | 0.55 |
| ▸ | PDE4A | P27815 | 5/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.53 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.53 |
| ▸ | PDE5A | O76074 | 2/20 | 0.53 |
| ▸ | PDE1A | P54750 | 2/20 | 0.53 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.53 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.53 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.50 |
| ▸ | PDE8A | O60658 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3269795 | 0.87 | ADORA2A (0.64) | ADORA2AADORA1PDE4APDE4BPDE4C | |
| SCHEMBL9738975 | 0.85 | ADORA2A (0.65) | ADORA2AADORA1CDK1CCNB1CCNE1 | |
| SCHEMBL3128315 | 0.85 | PDE4A (0.72) | ADORA2AADORA1PDE4APDE4BPDE4C | |
| SCHEMBL9738563 | 0.84 | CDK1 (0.55) | ADORA2AADORA1CDK1CCNB1CCNE1 | |
| SCHEMBL9741263 | 0.84 | ADORA2A (0.52) | ADORA2AADORA1CDK1CCNB1CCNE1 | |
| SCHEMBL9739455 | 0.84 | PDE4A (0.62) | ADORA2AADORA1PDE4APDE4BPDE4C | |
| SCHEMBL3268278 | 0.84 | ADORA2A (0.60) | ADORA2AADORA1PDE4APDE4BPDE4C | |
| SCHEMBL3269162 | 0.84 | ADORA2A (0.60) | ADORA2AADORA1PDE4APDE4BPDE4C | |
| SCHEMBL9739023 | 0.84 | PDE4A (0.72) | ADORA2AADORA1PDE4APDE4BPDE4C | |
| SCHEMBL9738116 | 0.84 | ADORA2A (0.60) | ADORA2AADORA1PDE4APDE4BPDE4C |
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-0363320-A2 | Substituted 9H purine | CIBA-GEIGY AG (CH) | 1990-04-11 | — | — | EP | claimed |
| US-5110818-A | Antiepileptic agents | CIBA-GEIGY CORPORATION (US) | 1992-05-05 | — | — | US | disclosed |
| EP-0363320-A2 | Substituted 9H purine | CIBA-GEIGY AG (CH) | 1990-04-11 | — | — | EP | disclosed |