Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.47 |
| ▸ | CDK2 | P24941 | 4/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.47 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.47 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9685206 | 0.84 | FDPS (0.43) | YTHDC1P2RY1ADORA2A | |
| SCHEMBL9685199 | 0.84 | ADORA2A (0.55) | ADORA3ADORA1ADORA2A | |
| SCHEMBL9686043 | 0.77 | NT5E (0.49) | ADORA3ADORA1CCNA2CDK2CDK5 | |
| SCHEMBL9704183 | 0.74 | ADORA3 (0.55) | ADORA3ADORA1YTHDC1 | |
| SCHEMBL9704179 | 0.74 | ADORA3 (0.53) | ADORA3ADORA1CCNA2CDK2CDK5 | |
| SCHEMBL9704176 | 0.70 | YTHDC1 (0.49) | ADORA3YTHDC1 | |
| SCHEMBL9685322 | 0.69 | YTHDC1 (0.60) | ADORA3ADORA1YTHDC1P2RY1 | |
| SCHEMBL27343883 | 0.68 | ADORA3 (0.55) | ADORA3ADORA1YTHDC1ADORA2A | |
| Hydrochloric Acid SCHEMBL27461588 | 0.68 | ADORA3 (0.58) | ADORA3ADORA1ADORA2A | |
| SCHEMBL30395433 | 0.67 | UBA6 (0.62) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1059528-A | The new carbocyclic analogs of some nucleosides | MERRELL DOW PHARMA (US) | 1992-03-18 | — | — | CN | disclosed |
| EP-0468866-A1 | Novel carbocyclic analogs of certain nucleosides | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-01-29 | — | — | EP | disclosed |
| EP-0468119-A1 | Novel carbocyclic analogs of certain nucleosides | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-01-29 | — | — | EP | disclosed |