Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.53 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7649694 | 0.82 | ALDH1A1 (0.82) | ALDH1A1CYP1A2CYP3A4CYP2D6CHRM3 | |
| SCHEMBL6589129 | 0.82 | CHRM2 (0.66) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL6587556 | 0.82 | CHRM2 (0.66) | CHRM3CHRM2CHRM1 | |
| SCHEMBL5544972 | 0.81 | ALDH1A1 (0.75) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL5542878 | 0.81 | ALDH1A1 (0.75) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL4298699 | 0.80 | ALDH1A1 (0.86) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL28075363 | 0.80 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL29409726 | 0.79 | ALDH1A1 (0.84) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL6589592 | 0.79 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT | |
| SCHEMBL1697179 | 0.78 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP3A4CYP2D6HTT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0823423-B1 | 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES | BANYU PHARMA CO LTD (JP) | 2004-06-16 | — | — | EP | claimed |
| CN-1188471-A | 1,4-disubstituted piepridine derivatives | BANYU PHARMA CO LTD (JP) | 1998-07-22 | — | — | CN | claimed |
| EP-0823423-A1 | 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-02-11 | — | — | EP | claimed |
| EP-0823423-B1 | 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES | BANYU PHARMA CO LTD (JP) | 2004-06-16 | — | — | EP | disclosed |
| CN-1188471-A | 1,4-disubstituted piepridine derivatives | BANYU PHARMA CO LTD (JP) | 1998-07-22 | — | — | CN | disclosed |
| US-5750540-A | SIDE EFFECT REDUCTION | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-05-12 | — | — | US | disclosed |
| EP-0823423-A1 | 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-02-11 | — | — | EP | disclosed |