Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | GAA | P10253 | 5/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | MPI | P34949 | 1/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | CASR | P41180 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11807279 | 0.83 | KDM4E (0.55) | ALDH1A1KDM4EGAALMNAHPGD | |
| SCHEMBL2902371 | 0.81 | KDM4E (0.51) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL15519297 | 0.81 | KDM4E (0.40) | ALDH1A1KDM4EGAALMNAGLA | |
| Hydrochloric Acid SCHEMBL11357932 | 0.80 | KDM4E (0.54) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL7886328 | 0.79 | ADRA2A (0.53) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL900644 | 0.79 | ADRA2A (0.53) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL900661 | 0.79 | ADRA2A (0.55) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL4063787 | 0.79 | ALDH1A1 (0.54) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL2899691 | 0.78 | MAPT (0.55) | ALDH1A1KDM4EGAALMNAGLA | |
| Hydrochloric Acid SCHEMBL900773 | 0.78 | ADRA2A (0.52) | ALDH1A1KDM4EGAALMNAGLA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| US-5753664-A | ANTITUMOR AGENTS, PYRIMIDONES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |