Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9856862 | 0.79 | HTR2A (0.49) | KDM4EAOC3HTR7CHRM2CYP2D6 | |
| SCHEMBL9856602 | 0.74 | CYP2D6 (0.45) | ALDH1A1HTR7CYP2D6POLBHTT | |
| SCHEMBL9857222 | 0.73 | HTR2A (0.49) | KDM4EALDH1A1CHRM2CYP2D6CYP3A4 | |
| SCHEMBL5403632 | 0.68 | HTR7 (0.46) | KDM4EALDH1A1HTR7CYP3A4POLB | |
| SCHEMBL9856971 | 0.67 | KDM4E (0.38) | KDM4EALDH1A1HTR7SLC6A2SLC6A4 | |
| SCHEMBL9856935 | 0.67 | SLC6A2 (0.49) | KDM4EHTR7CHRM2CYP2D6SLC6A2 | |
| SCHEMBL2937482 | 0.66 | AOC3 (0.73) | AOC3HTR7CHRM2KCNH2TAAR1 | |
| SCHEMBL9230337 | 0.66 | HTR2A (0.65) | KDM4EHTR7CHRM2CYP2D6CYP3A4 | |
| SCHEMBL9857031 | 0.66 | PPARG (0.41) | ALDH1A1HTR7CYP2D6SLC6A4MAPT | |
| SCHEMBL8129763 | 0.66 | KDM4E (0.82) | KDM4EALDH1A1HTR7CYP2D6HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4996235-A | Selectively inhibiting the uptake of serotonin and norepinephrine | ELI LILLY AND COMPANY (US) | 1991-02-26 | — | — | US | disclosed |