Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 15/20 | 0.68 |
| ▸ | ADORA1 | P30542 | 15/20 | 0.68 |
| ▸ | ADORA2A | P29274 | 14/20 | 0.68 |
| ▸ | ADORA2B | P29275 | 9/20 | 0.68 |
| ▸ | PI4KA | P42356 | 2/20 | 0.68 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.68 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.68 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.68 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | CHUK | O15111 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | ITK | Q08881 | 1/20 | 0.45 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.44 |
| ▸ | NAE1 | Q13564 | 1/20 | 0.41 |
| ▸ | UBA3 | Q8TBC4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL783764 | 0.81 | ADORA3 (0.68) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4064829 | 0.81 | ADORA2A (1.00) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL9487201 | 0.81 | ADORA3 (0.71) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL6660016 | 0.77 | ADORA3 (0.62) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL6660588 | 0.76 | ADORA3 (0.60) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL12843974 | 0.74 | ADORA3 (0.51) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4067321 | 0.73 | ADORA3 (0.57) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL27854929 | 0.72 | PI4KA (0.68) | PI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL6660434 | 0.72 | ADORA3 (0.55) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4066022 | 0.72 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AADORA2B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0383759-B1 | N6 SUBSTITUTED 9-METHYLADENINES: A NEW CLASS OF ADENOSINE RECEPTOR ANTAGONISTS | DISCOVERY THERAPEUTICS INC (US) | 1998-09-09 | — | — | EP | disclosed |
| EP-0383759-A4 | N?6 -SUBSTITUTED 9-METHYLADENINES: A NEW CLASS OF ADENOSINE RECEPTOR ANTAGONISTS | — | 1993-03-17 | — | — | EP | disclosed |
| EP-0383759-A1 | N6 SUBSTITUTED 9-METHYLADENINES: A NEW CLASS OF ADENOSINE RECEPTOR ANTAGONISTS | Whitby Research Incorporated (US) | 1990-08-29 | — | — | EP | disclosed |
| WO-1988008303-A1 | N6-SUBSTITUTED 9-METHYLADENINES: A NEW CLASS OF ADENOSINE RECEPTOR ANTAGONISTS | NELSON RESEARCH AND DEVELOPMENT COMPANY (US) | 1988-11-03 | — | — | WO | disclosed |