Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | KHK | P50053 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.39 |
| ▸ | WNT1 | P04628 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | QPCT | Q16769 | 1/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL18318449 | 0.99 | HRH3 (0.43) | HRH3PIK3C3HRH1KHKROCK1 | |
| SCHEMBL18322908 | 0.79 | PIK3C3 (0.49) | HRH3PIK3C3CHEK2 | |
| Hydrochloric Acid SCHEMBL18322940 | 0.79 | PIK3C3 (0.49) | HRH3PIK3C3CHEK2 | |
| SCHEMBL16775568 | 0.78 | HRH1 (0.45) | HRH3HRH1ROCK1IKBKBPRKCZ | |
| SCHEMBL18319428 | 0.77 | PIK3C3 (0.47) | HRH3PIK3C3 | |
| Hydrochloric Acid SCHEMBL18319008 | 0.76 | PIK3C3 (0.46) | HRH3PIK3C3 | |
| SCHEMBL2019376 | 0.76 | HRH1 (0.70) | HRH3HRH1KHKROCK1IKBKB | |
| SCHEMBL14826051 | 0.76 | PIK3C3 (0.51) | PIK3C3TGFBR1DYRK1AQPCTFLT3 | |
| SCHEMBL28912555 | 0.75 | GPR119 (0.51) | HRH3PIK3C3CHEK2 | |
| SCHEMBL24231695 | 0.75 | PIK3C3 (0.41) | HRH3PIK3C3ROCK1IKBKBQPCT |
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 |