Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | PLG | P00747 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.33 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.33 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.33 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12009925 | 0.92 | ADORA2A (0.35) | ADORA2AF2PLGPRSS1PRSS2 | |
| SCHEMBL12009920 | 0.91 | ADORA2A (0.35) | ADORA2A | |
| SCHEMBL12009913 | 0.90 | TPSAB1 (0.36) | ADORA2AF2PLGPRSS1PRSS2 | |
| SCHEMBL12009912 | 0.82 | TPSAB1 (0.33) | ADORA2AF2PLGPRSS1PRSS2 | |
| SCHEMBL12374999 | 0.79 | ADORA2A (0.59) | ADORA2AADORA3ADORA1 | |
| SCHEMBL12009917 | 0.79 | TPSAB1 (0.35) | ADORA2AF2PLGPRSS1PRSS2 | |
| SCHEMBL14947643 | 0.74 | ADORA2A (0.59) | ADORA2AADORA3ADORA1 | |
| SCHEMBL13819323 | 0.74 | ADORA2A (0.34) | ADORA2ASMYD2 | |
| SCHEMBL12952377 | 0.73 | ADORA2A (0.63) | ADORA2AADORA3ADORA1 | |
| SCHEMBL13819321 | 0.73 | ADORA2A (0.33) | ADORA2A |
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-8252767-B2 | Substituted 4-{3-[6-amino-9-(3, 4-dihydroxy-tetrahydro-furan-2-yl)-9H-purin-2-yl]-prop-2-ynyl}-piperidine-1-carboxylic acid esters as A2AR agonists | DOGWOOD PHARMACEUTICALS, INC. (US) | 2012-08-28 | — | — | US | disclosed |