Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 11/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL879247 | 0.71 | SLC6A2 (0.57) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL28014051 | 0.69 | SLC6A2 (0.43) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL13766112 | 0.65 | GSTO1 (0.49) | SLC6A2SLC6A3SLC6A4CYP2D6CYP3A4 | |
| SCHEMBL5585043 | 0.65 | SLC6A2 (0.50) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL16001235 | 0.65 | QDPR (0.57) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL5585044 | 0.65 | SLC6A2 (0.58) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL30177185 | 0.65 | SLC6A2 (0.58) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL30272564 | 0.65 | SLC6A2 (0.58) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL7001619 | 0.63 | CYP3A4 (0.45) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL8134479 | 0.63 | CYP3A4 (0.45) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 |
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-3307254-B1 | MITO-HONOKIOL COMPOUNDS AND METHODS OF SYNTHESIS AND USE THEREOF | MEDICAL COLLEGE WISCONSIN INC (US) | 2020-08-05 | — | — | EP | disclosed |