Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | PDE9A | O76083 | 2/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7669302 | 0.92 | ADORA2A (0.53) | ADORA2AADORA2BADORA1ADORA3PDE9A | |
| SCHEMBL8560943 | 0.81 | ADORA2A (0.46) | ADORA2AADORA2BADORA1 | |
| SCHEMBL7661349 | 0.78 | ADORA2A (0.58) | ADORA2AADORA2BADORA1ADORA3MEN1 | |
| SCHEMBL7669942 | 0.75 | ADORA2A (0.47) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL8558501 | 0.75 | ADORA1 (0.45) | ADORA2AADORA2BADORA1 | |
| SCHEMBL8559224 | 0.73 | ADORA1 (0.61) | ADORA2AADORA2BADORA1ADORA3MEN1 | |
| SCHEMBL7671399 | 0.71 | ADORA1 (0.40) | ADORA2AADORA2BADORA1ADORA3MEN1 | |
| SCHEMBL7669969 | 0.71 | ADORA1 (0.40) | ADORA2AADORA2BADORA1ADORA3MEN1 | |
| SCHEMBL8562980 | 0.71 | ADORA1 (0.57) | ADORA2AADORA2BADORA1ADORA3MEN1 | |
| SCHEMBL11021594 | 0.68 | ADORA2A (0.53) | ADORA2AADORA2BADORA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0880524-A1 | NEW TRIAZOLOPURINES, METHOD OF PREPARING THEM AND THEIR USE AS DRUGS | Boehringer Ingelheim Pharma KG (DE) | 1998-12-02 | — | — | EP | disclosed |
| WO-1998003511-A1 | NEW TRIAZOLOPURINES, METHOD OF PREPARING THEM AND THEIR USE AS DRUGS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1998-01-29 | — | — | WO | disclosed |