Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | SLC18A2 | Q05940 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9538362 | 0.84 | ACHE (0.48) | ACHEALDH1A1CYP3A4HPGDCYP2C19 | |
| SCHEMBL9537087 | 0.83 | TSHR (0.54) | ACHEALDH1A1CYP3A4HPGDCYP2C19 | |
| SCHEMBL9537175 | 0.81 | HRH1 (0.53) | ALDH1A1CYP2C19DRD2DRD3MEN1 | |
| SCHEMBL9536342 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP2C19MEN1LMNACYP1A2 | |
| SCHEMBL10550233 | 0.79 | ACHE (0.51) | ACHEALDH1A1CYP3A4HPGDCYP2C19 | |
| SCHEMBL10551946 | 0.78 | TSHR (0.52) | ACHEALDH1A1CYP3A4HPGDCYP2C19 | |
| SCHEMBL9539219 | 0.76 | HRH1 (0.42) | ALDH1A1DRD2DRD3MEN1LMNA | |
| SCHEMBL9537082 | 0.76 | HTR2A (0.56) | ALDH1A1CYP3A4HPGDCYP2C19SLC6A3 | |
| SCHEMBL9536214 | 0.75 | SLC18A2 (0.53) | ACHEALDH1A1CYP3A4HPGDCYP2C19 | |
| SCHEMBL9539277 | 0.75 | ALDH1A1 (0.49) | ALDH1A1CYP3A4HPGDDRD2MEN1 |
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-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | claimed |