Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | ATG4B | Q9Y4P1 | 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 | |
|---|---|---|---|---|
| SCHEMBL7015766 | 0.92 | SMN1; SMN2 (0.49) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7014333 | 0.91 | HPGD (0.49) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7018977 | 0.90 | MEN1 (0.48) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7016083 | 0.88 | HPGD (0.47) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7016154 | 0.88 | MEN1 (0.45) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7016066 | 0.88 | MEN1 (0.47) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7010368 | 0.87 | SMN1; SMN2 (0.52) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7008899 | 0.86 | SLC6A7 (0.52) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7009962 | 0.85 | MEN1 (0.44) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 | |
| SCHEMBL7014757 | 0.85 | MEN1 (0.44) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MEN1 |
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 |