Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 13/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | PNP | P00491 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5369682 | 0.88 | ADORA3 (0.48) | ADORA3ADORA2AADORA1PDE4DPDE3A | |
| SCHEMBL5372681 | 0.88 | ADORA3 (0.48) | ADORA3ADORA2AADORA1PDE4DPDE3A | |
| SCHEMBL14543436 | 0.85 | ADORA3 (0.48) | ADORA3ADORA2AADORA1HSP90B1CD99 | |
| SCHEMBL14543432 | 0.85 | NT5E (0.41) | ADORA3ADORA2AADORA1CD99NT5E | |
| SCHEMBL14543434 | 0.85 | ADORA3 (0.58) | ADORA3ADORA2AADORA1HSP90B1NT5E | |
| SCHEMBL14543426 | 0.81 | ADORA3 (0.56) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL5359757 | 0.76 | ADORA3 (0.52) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL5359756 | 0.76 | ADORA3 (0.52) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL14543483 | 0.75 | ADORA3 (0.44) | ADORA3ADORA2AADORA1NT5E | |
| SCHEMBL20333315 | 0.74 | ADORA3 (0.66) | ADORA3ADORA2AADORA1PDE4DPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| US-7199127-B2 | Purine nucleosides | UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2007-04-03 | — | — | US | disclosed |