Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 9/20 | 0.69 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.69 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.69 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.69 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | SELP | P16109 | 1/20 | 0.34 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.33 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6553553 | 1.00 | ADORA2B (0.69) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL6554054 | 0.98 | ADORA2B (0.72) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL6554049 | 0.98 | ADORA2B (0.72) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL5616731 | 0.97 | ADORA2B (0.74) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL6555070 | 0.97 | ADORA2B (0.74) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL6555076 | 0.97 | ADORA2B (0.74) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL5616732 | 0.97 | ADORA2B (0.74) | ADORA2BADORA3ADORA2AADORA1RARB | |
| Hydrochloric Acid SCHEMBL6554025 | 0.96 | ADORA2B (0.73) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL6555729 | 0.96 | ADORA2B (0.66) | ADORA2BADORA3ADORA2AADORA1RARB | |
| SCHEMBL6555722 | 0.96 | ADORA2B (0.66) | ADORA2BADORA3ADORA2AADORA1RARB |
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-1104422-B1 | PHENYL XANTHINE DERIVATIVES | GLAXO GROUP LTD (GB) | 2004-02-18 | — | — | EP | disclosed |
| EP-0775141-B1 | PHENYL XANTHINE DERIVATIVES | WELLCOME FOUND (GB) | 2001-09-26 | — | — | EP | disclosed |
| EP-0775141-A1 | PHENYL XANTHINE DERIVATIVES | THE WELLCOME FOUNDATION LIMITED (GB) | 1997-05-28 | — | — | EP | disclosed |
| WO-1996004280-A1 | PHENYL XANTHINE DERIVATIVES | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-02-15 | — | — | WO | disclosed |