Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.32 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.32 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.32 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.32 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.32 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5161207 | 0.82 | KDM4E (0.50) | KDM4EFDPSENPP2TUBB1ESR1 | |
| SCHEMBL5147276 | 0.82 | KDM4E (0.50) | KDM4EFDPSENPP2TUBB1ESR1 | |
| SCHEMBL18854461 | 0.79 | KDM4E (0.47) | KDM4EFDPSENPP2TUBB1ESR1 | |
| SCHEMBL18854463 | 0.79 | KDM4E (0.47) | KDM4EFDPSENPP2TUBB1ESR1 | |
| SCHEMBL17226683 | 0.78 | KDM4E (0.42) | KDM4EFDPSENPP2ESR1 | |
| SCHEMBL8928887 | 0.75 | KDM4E (0.43) | KDM4EFDPSENPP2TUBB1ESR1 | |
| SCHEMBL4214931 | 0.75 | FDPS (0.65) | KDM4EFDPSTUBB1CYP1A2ABCG2 | |
| SCHEMBL4214927 | 0.75 | FDPS (0.65) | KDM4EFDPSTUBB1CYP1A2ABCG2 | |
| SCHEMBL15688424 | 0.74 | KDM4E (0.46) | KDM4EFDPSENPP2TUBB1ESR1 | |
| SCHEMBL1108192 | 0.74 | KDM4E (0.46) | KDM4EFDPSENPP2TUBB1ESR1 |
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-3107900-B1 | 5-BENZYLISOQUINOLEINE DERIVATIVES FOR THE TREATMENT OF CARDIOVASCULAR DISEASES | SERVIER LAB (FR) | 2017-11-15 | — | — | EP | disclosed |