Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 3/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.63 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.63 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.63 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3170151 | 0.95 | ADORA2B (0.56) | ADORA2BADORA3ADORA2AADORA1FAAH | |
| SCHEMBL3162725 | 0.92 | ADORA2B (0.53) | ADORA2BADORA3ADORA2AADORA1HTR2A | |
| SCHEMBL3167779 | 0.91 | ADORA2B (0.52) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL3164833 | 0.90 | ADORA2B (0.49) | ADORA2BADORA3ADORA2AADORA1MEN1 | |
| SCHEMBL3165340 | 0.90 | ADORA2B (0.49) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL3171345 | 0.90 | ADORA2B (0.49) | ADORA2BADORA3ADORA2AADORA1FAAH | |
| SCHEMBL3171242 | 0.88 | ADORA2A (0.48) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL3162838 | 0.88 | ADORA3 (0.58) | ADORA2BADORA3ADORA2AADORA1FAAH | |
| SCHEMBL3173228 | 0.88 | ADORA1 (0.47) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL3155892 | 0.88 | ADORA2A (0.46) | ADORA2BADORA3ADORA2AADORA1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |