Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | FDPS | P14324 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 3/20 | 0.37 |
| ▸ | WEE1 | P30291 | 1/20 | 0.36 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.35 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | HRH1 | P35367 | 2/20 | 0.35 |
| ▸ | CCR3 | P51677 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18322859 | 0.84 | ROCK1 (0.45) | ROCK1FDPSHTR1AHRH3KCNH2 | |
| SCHEMBL18318548 | 0.82 | FDPS (0.37) | ROCK1FDPSHTR1AWEE1HRH3 | |
| SCHEMBL18322904 | 0.82 | GSK3B (0.42) | HTR1ACARM1PRMT6HRH3KCNH2 | |
| SCHEMBL18322946 | 0.81 | HTR7 (0.37) | ROCK1HTR1ACARM1PRMT6HRH3 | |
| SCHEMBL18322880 | 0.80 | ROCK1 (0.43) | ROCK1FDPSHTR1ACARM1PRMT6 | |
| SCHEMBL18322871 | 0.80 | ROCK1 (0.42) | ROCK1FDPSHTR1AHRH3KCNH2 | |
| SCHEMBL18318933 | 0.78 | PIK3CD (0.48) | FDPSKMT2ASMYD3 | |
| SCHEMBL18322863 | 0.78 | ESR1 (0.45) | HTR1ACARM1PRMT6HRH3 | |
| SCHEMBL18318543 | 0.78 | ALDH1A1 (0.50) | FDPSKDM4EALDH1A1 | |
| SCHEMBL18322939 | 0.77 | GSK3B (0.43) | HTR1AHRH3ADRA1A |
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-3310441-A1 | 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES | Cephalon, Inc. (US) | 2018-04-25 | — | — | EP | disclosed |
| WO-2016205633-A1 | 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES | CEPHALON, INC. (US) | 2016-12-22 | — | — | WO | disclosed |