Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 2/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 3/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.39 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.39 |
| ▸ | PRKX | P51817 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27763565 | 1.00 | KDM4E (0.43) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL1412351 | 0.89 | KDM4E (0.40) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL27763562 | 0.84 | KDM4E (0.42) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL27763561 | 0.82 | CXCR2 (0.40) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL7658491 | 0.76 | KDM4E (0.44) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL7085340 | 0.74 | ADORA2A (0.47) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL27564857 | 0.74 | ADORA2A (0.47) | KDM4EMEN1MAPTKMT2AMME | |
| Hydrochloric Acid SCHEMBL7088885 | 0.74 | ADORA2A (0.47) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL5891801 | 0.70 | KDM4E (0.48) | KDM4EMEN1MAPTKMT2AMME | |
| SCHEMBL5891322 | 0.70 | KDM4E (0.48) | KDM4EMEN1MAPTKMT2AMME |
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 |
|---|---|---|---|---|---|---|---|
| CN-101437829-B | Bisadenosine compounds as adenosine A2A receptor agonists | NOVARTIS AG | 2012-03-21 | — | — | CN | disclosed |
| CN-101437829-A | Bisadenosine compounds as adenosine A2A receptor agonists | NOVARTIS AG (CH) | 2009-05-20 | — | — | CN | disclosed |