Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | CLK2 | P49760 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TOP1 | P11387 | 5/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6948985 | 0.91 | CYP3A4 (0.58) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15062973 | 0.89 | CYP3A4 (0.47) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15062921 | 0.89 | CYP3A4 (0.45) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15090843 | 0.89 | KDM4E (0.44) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15090743 | 0.87 | KCNH2 (0.46) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15090876 | 0.86 | KCNH2 (0.45) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15090739 | 0.86 | KCNH2 (0.44) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15090899 | 0.86 | KCNH2 (0.44) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL15090877 | 0.86 | KCNH2 (0.42) | CYP3A4KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL4748873 | 0.85 | CYP3A4 (0.56) | CYP3A4KCNH2KDM4EHPGDALDH1A1 |
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-0807630-B1 | HETEROCYCLIC COMPOUNDS | DAIICHI SEIYAKU CO (JP) | 2003-05-07 | — | — | EP | claimed |