Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 4/20 | 0.55 |
| ▸ | DRD3 | P35462 | 3/20 | 0.55 |
| ▸ | SETD7 | Q8WTS6 | 2/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | DRD1 | P21728 | 1/20 | 0.55 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9844283 | 0.96 | CYP3A4 (0.58) | CYP3A4HTTHTR1ADRD3SETD7 | |
| Hydrochloric Acid SCHEMBL9844493 | 0.95 | CYP3A4 (0.57) | CYP3A4HTTHTR1ADRD3SETD7 | |
| SCHEMBL9844502 | 0.91 | CYP3A4 (0.61) | CYP3A4HTTHTR1ADRD3SETD7 | |
| SCHEMBL9844279 | 0.86 | FNTA (0.54) | CYP3A4HTTHTR1ADRD3SETD7 | |
| Hydrochloric Acid SCHEMBL9844374 | 0.85 | FNTA (0.53) | CYP3A4HTTHTR1ADRD3SETD7 | |
| SCHEMBL9844251 | 0.85 | FNTA (0.53) | CYP3A4HTTHTR1ADRD3SETD7 | |
| SCHEMBL9844244 | 0.85 | FNTA (0.53) | CYP3A4HTTHTR1ADRD3SETD7 | |
| SCHEMBL9844384 | 0.85 | FNTA (0.53) | CYP3A4HTTHTR1ADRD3SETD7 | |
| SCHEMBL9718809 | 0.85 | SETD7 (0.54) | HTR1ADRD3SETD7CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL9844268 | 0.84 | FNTA (0.52) | CYP3A4HTTHTR1ADRD3SETD7 |
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-0451772-A1 | Piperidine compounds, method for preparation thereof, and a pharamceutical composition comprising the same | HOKURIKU PHARMACEUTICAL CO., LTD. (JP) | 1991-10-16 | — | — | EP | disclosed |