Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 7/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9114665 | 0.87 | DRD2 (0.49) | CYP3A4CYP2D6KDM4EALDH1A1 | |
| SCHEMBL9116820 | 0.87 | MAOB (0.51) | KCNH2KDM4EMTNR1AMTNR1BMAOB | |
| SCHEMBL9115835 | 0.84 | HTR2A (0.50) | CYP3A4CYP2D6KDM4EALDH1A1 | |
| SCHEMBL9115981 | 0.84 | HTR2A (0.50) | CYP3A4CYP2D6KDM4EALDH1A1 | |
| SCHEMBL9115963 | 0.84 | HTR2A (0.50) | CYP3A4CYP2D6KDM4EALDH1A1 | |
| SCHEMBL9115389 | 0.82 | MAPT (0.45) | KCNH2POLBTDP1ALDH1A1 | |
| SCHEMBL9117585 | 0.82 | HTR2A (0.51) | CYP2C19ALDH1A1 | |
| SCHEMBL9117040 | 0.81 | MAOB (0.51) | KCNH2CYP3A4KDM4EMAOBALDH1A1 | |
| SCHEMBL9116972 | 0.80 | DRD2 (0.47) | CYP3A4CYP2D6KDM4E | |
| SCHEMBL9116078 | 0.79 | HTR2A (0.51) | CYP3A4CYP2D6KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995025731-A1 | NOVEL 3-(φ-(4-BENZOYLPIPERIDINO)ALKYL)-4H-BENZOPYRAN-4-ONES, PREPARATION AND THERAPEUTICAL USE THEREOF | PIERRE FABRE MEDICAMENT (FR) | 1995-09-28 | — | — | WO | disclosed |