Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 7/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | KCNE1 | P15382 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2587778 | 0.98 | CYP2D6 (0.42) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL1855360 | 0.83 | CHRM2 (0.46) | CYP2D6KCNH2KMT2AMEN1MC4R | |
| SCHEMBL7442466 | 0.76 | CYP2D6 (0.50) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL7447627 | 0.72 | KCNA5 (0.45) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL1743050 | 0.72 | GAA (0.46) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL7795568 | 0.71 | KCNA5 (0.37) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL20191913 | 0.71 | CYP2D6 (0.79) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL1406105 | 0.71 | CYP2D6 (0.79) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL2631769 | 0.71 | CYP2D6 (0.79) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL7444395 | 0.70 | CYP2D6 (0.44) | CYP2D6KCNA5CYP3A4CYP2C19CYP1A2 |
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-0584192-A1 | PRODRUG ESTERS OF PHENOLIC 2-PIPERIDINO-1-ALKANOLS | PFIZER INC. (US) | 1994-03-02 | — | — | EP | disclosed |