Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 8/20 | 0.66 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 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 | |
|---|---|---|---|---|
| SCHEMBL7153750 | 0.85 | ADORA2A (0.71) | ADORA2AALDH1A1KDM4EADORA3ADORA1 | |
| SCHEMBL6868343 | 0.82 | ADORA2A (0.45) | ADORA2AMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL6871729 | 0.81 | ADORA2A (0.62) | ADORA2AMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL6863751 | 0.81 | ADORA2A (0.62) | ADORA2AMAPTNPC1TP53RAB9A | |
| SCHEMBL6871212 | 0.81 | ALDH1A1 (0.48) | ADORA2AMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL6871503 | 0.81 | ADORA2A (0.43) | ADORA2AMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL6871970 | 0.81 | ADORA2A (0.43) | ADORA2AMAPTSMN1; SMN2HPGD | |
| SCHEMBL6872088 | 0.80 | MYC (0.56) | ADORA2AMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL6870384 | 0.80 | ADORA2A (0.58) | ADORA2AMAPTALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL6869223 | 0.80 | ADORA2A (1.00) | ADORA2ANPC1TP53RAB9AALDH1A1 |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |