Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 17/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6440919 | 0.84 | ADORA2A (0.56) | ADORA1ADORA2AADORA2BKDM4EMEN1 | |
| SCHEMBL7145343 | 0.82 | ADORA1 (0.41) | ADORA1ADORA2AADORA2BKDM4EMEN1 | |
| SCHEMBL5040238 | 0.76 | SQOR (0.37) | ADORA1ADORA2AADORA2BALDH1A1POLB | |
| SCHEMBL6444873 | 0.70 | ADORA1 (0.34) | ADORA1ADORA2AADORA2BKDM4EALDH1A1 | |
| SCHEMBL5139767 | 0.70 | ADORA1 (0.43) | ADORA1ADORA2AADORA2BKDM4EMEN1 | |
| SCHEMBL5133351 | 0.69 | TLR7 (0.38) | ADORA1ADORA2AADORA2BKDM4EMEN1 | |
| SCHEMBL6442327 | 0.69 | HSP90AA1 (0.33) | ALDH1A1POLB | |
| SCHEMBL6443293 | 0.68 | CYP1A2 (0.49) | ADORA1ADORA2AADORA2BKDM4EMEN1 | |
| SCHEMBL6444534 | 0.68 | ADORA2A (0.55) | ADORA1ADORA2AADORA2BKDM4EMEN1 | |
| Pyridine SCHEMBL7881098 | 0.68 | ADORA1 (0.40) | ADORA1ADORA2AADORA2BKDM4EALDH1A1 |
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-1261327-B1 | ADENOSINE RECEPTOR MODULATORS | HOFFMANN LA ROCHE (CH) | 2005-04-27 | — | — | EP | disclosed |