Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.67 |
| ▸ | MAOB | P27338 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.55 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.51 |
| ▸ | HRH1 | P35367 | 4/20 | 0.50 |
| ▸ | HRH2 | P25021 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL737615 | 0.83 | HRH3 (0.58) | HRH3MAOBKDM4EALDH1A1KCNH2 | |
| SCHEMBL737616 | 0.81 | HRH3 (0.58) | HRH3MAOBALDH1A1KCNH2 | |
| Trifluoroacetic Acid SCHEMBL735635 | 0.80 | HRH3 (0.57) | HRH3KDM4EALDH1A1KCNH2CACNA1B | |
| SCHEMBL492129 | 0.80 | HRH3 (1.00) | HRH3MAOBKDM4EHRH1HRH2 | |
| Trifluoroacetic Acid SCHEMBL3573078 | 0.79 | HRH1 (0.58) | HRH3ALDH1A1KCNH2SMN1; SMN2HRH1 | |
| Trifluoroacetic Acid SCHEMBL736519 | 0.79 | HRH3 (0.55) | HRH3KDM4EALDH1A1KCNH2CACNA1B | |
| SCHEMBL492028 | 0.79 | HRH3 (0.92) | HRH3MAOBKDM4EALDH1A1HRH1 | |
| SCHEMBL491638 | 0.79 | HRH3 (0.92) | HRH3MAOBKDM4EALDH1A1KCNH2 | |
| Trifluoroacetic Acid SCHEMBL738424 | 0.79 | HRH3 (0.52) | HRH3KDM4EALDH1A1KCNH2CACNA1B | |
| Oxalic Acid SCHEMBL5856199 | 0.78 | HRH3 (0.86) | HRH3MAOBKDM4EALDH1A1SMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8138206-B2 | Piperidine derivative | MSD. K.K. (JP) | 2012-03-20 | — | — | US | claimed |
| EP-1892241-A1 | NOVEL PIPERIDINE DERIVATIVE | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2008-02-27 | — | — | EP | claimed |
| US-8138206-B2 | Piperidine derivative | MSD. K.K. (JP) | 2012-03-20 | — | — | US | disclosed |
| EP-1892241-A1 | NOVEL PIPERIDINE DERIVATIVE | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2008-02-27 | — | — | EP | disclosed |