Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.56 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.56 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.56 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.56 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.56 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.56 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.56 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.56 |
| ▸ | CYP4F8 | P98187 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL1996001 | 0.90 | KDM4E (0.51) | KDM4EHRH3BACE1KCNH2LMNA | |
| SCHEMBL20410843 | 0.88 | KDM4E (0.59) | CYP2D6KDM4EHRH3LMNAMAPT | |
| SCHEMBL10768863 | 0.87 | KDM4E (0.45) | CYP1A1CYP1B1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL471881 | 0.85 | KDM4E (0.62) | CYP2D6KDM4EHRH3LMNAMAPT | |
| SCHEMBL20410735 | 0.84 | KDM4E (0.54) | CYP2D6KDM4EHRH3LMNAMAPT | |
| SCHEMBL20396188 | 0.82 | KDM4E (0.53) | CYP2D6KDM4EHRH3LMNAMAPT | |
| SCHEMBL29689817 | 0.82 | KDM4E (0.53) | CYP2D6KDM4EHRH3LMNAMAPT | |
| SCHEMBL20410829 | 0.81 | KDM4E (0.51) | CYP2D6KDM4EHRH3LMNAMAPT | |
| SCHEMBL8444082 | 0.80 | KDM4E (0.50) | CYP2D6KDM4EHRH3BACE1KCNH2 | |
| SCHEMBL20410729 | 0.80 | KDM4E (0.53) | CYP2D6KDM4EHRH3LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5968985-A | INHIBITORS OF SODIUM ION/HYDROGEN ION EXCHANGE IN CELLS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1999-10-19 | — | — | US | disclosed |
| EP-0773927-A2 | BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-05-21 | — | — | EP | disclosed |
| WO-1996004241-A2 | BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-02-15 | — | — | WO | disclosed |