Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.57 |
| ▸ | HRH1 | P35367 | 4/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.54 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | NPY1R | P25929 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9537111 | 0.88 | KCNH2 (0.63) | HTR3AKCNH2HRH1CYP2D6CYP3A4 | |
| SCHEMBL9537283 | 0.87 | KCNH2 (0.58) | HTR3AKCNH2CYP2D6SMN1; SMN2HTT | |
| Water SCHEMBL10550887 | 0.86 | KCNH2 (0.57) | HTR3AKCNH2CYP2D6SMN1; SMN2HTT | |
| SCHEMBL9382803 | 0.85 | KCNH2 (0.64) | HTR3AKCNH2HRH1CYP2D6CYP3A4 | |
| SCHEMBL9537835 | 0.85 | SSTR5 (0.59) | KCNH2HRH1CYP2D6SMN1; SMN2HTT | |
| SCHEMBL9539234 | 0.84 | LMNA (0.58) | SMN1; SMN2HTTLMNAALDH1A1TP53 | |
| SCHEMBL9537829 | 0.83 | KCNH2 (0.58) | HTR3AKCNH2TBXA2R | |
| SCHEMBL9537631 | 0.83 | HRH1 (0.54) | HTR3AKCNH2HRH1CYP2D6CYP3A4 | |
| Hydrochloric Acid SCHEMBL9539127 | 0.82 | KCNH2 (0.56) | HTR3AKCNH2HTTALDH1A1TBXA2R | |
| SCHEMBL1584245 | 0.80 | KCNH2 (0.63) | KCNH2HRH1CYP2D6CYP3A4LMNA |
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 3 patents. 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 | disclosed |
| US-4839374-A | TREATING ALLERGIES | JANSSEN PHARMACEUTICA, N.V. (BE) | 1989-06-13 | — | — | US | disclosed |
| EP-0151826-A1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1985-08-21 | — | — | EP | disclosed |