Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 9/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.57 |
| ▸ | HTR3A | P46098 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 8/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9382803 | 0.91 | KCNH2 (0.64) | KCNH2NR4A2HTR3ARAB9AHRH1 | |
| SCHEMBL9537151 | 0.87 | SSTR5 (0.59) | KCNH2RAB9AHRH1CHRM1CYP2D6 | |
| Fumaric Acid SCHEMBL10818415 | 0.82 | KCNH2 (0.55) | KCNH2NR4A2HTR3ARAB9AHRH1 | |
| SCHEMBL9536543 | 0.82 | SSTR5 (0.66) | KCNH2RAB9AHRH1CHRM1CYP2D6 | |
| SCHEMBL9537283 | 0.81 | KCNH2 (0.58) | KCNH2NR4A2HTR3ACYP2D6 | |
| SCHEMBL9537797 | 0.81 | RAB9A (0.57) | KCNH2HTR3ARAB9AHRH1CHRM1 | |
| SCHEMBL9698374 | 0.81 | KCNH2 (0.83) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| Oxalic Acid SCHEMBL9535472 | 0.81 | PTGS1 (0.48) | KCNH2RAB9AHRH1CHRM1CYP2D6 | |
| Oxalic Acid SCHEMBL10799713 | 0.81 | PTGS1 (0.48) | KCNH2RAB9AHRH1CHRM1CYP2D6 | |
| Oxalic Acid SCHEMBL9535477 | 0.81 | PTGS1 (0.48) | KCNH2RAB9AHRH1CHRM1CYP2D6 |
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 2 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 |
| EP-0151826-A1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1985-08-21 | — | — | EP | disclosed |