Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHPS | P49366 | 4/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | UBE2N | P61088 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CCR9 | P51686 | 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 | |
|---|---|---|---|---|
| SCHEMBL6426783 | 0.86 | NR1H2 (0.47) | NR1H2NR1H3CHRM5KDM4EALDH1A1 | |
| SCHEMBL6466541 | 0.82 | L3MBTL1 (0.51) | DHPSCYP2E1CYP3A4CYP2D6CYP2A6 | |
| SCHEMBL6428548 | 0.79 | NR1H2 (0.56) | L3MBTL1NR1H2NR1H3LMNAALDH1A1 | |
| SCHEMBL6429546 | 0.77 | OPRK1 (0.40) | CYP2C19NR1H2NR1H3ALDH1A1 | |
| SCHEMBL6428246 | 0.77 | GSK3B (0.39) | CYP2D6NR1H2NR1H3KDM4EALDH1A1 | |
| SCHEMBL4688137 | 0.75 | KDM4E (0.51) | DHPSCYP2E1CYP3A4CYP2D6CYP2A6 | |
| SCHEMBL6429024 | 0.74 | PTGS2 (0.46) | NR1H2NR1H3 | |
| SCHEMBL6427166 | 0.74 | CASP1 (0.47) | CYP2C19NR1H2NR1H3KDM4ELMNA | |
| SCHEMBL6429398 | 0.73 | NPSR1 (0.41) | L3MBTL1NR1H2NR1H3ATMLMNA | |
| SCHEMBL6427122 | 0.72 | NR1H2 (0.47) | NR1H2NR1H3CHRM5LMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005024755-A2 | MEDICAMENTS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS OR DIABETES | DECIPHERA PHARMACEUTICALS, LLC. (US) | 2005-03-17 | — | — | WO | disclosed |