Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.42 |
| ▸ | STS | P08842 | 2/20 | 0.41 |
| ▸ | FPR1 | P21462 | 3/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21342468 | 1.00 | PDE4B (0.45) | PDE4BALDH1A1GPR119STSFPR1 | |
| SCHEMBL21342556 | 0.94 | PDE4B (0.42) | PDE4BALDH1A1GPR119STSDPP4 | |
| SCHEMBL21342312 | 0.87 | ALDH1A1 (0.47) | PDE4BALDH1A1GPR119STSEPHX2 | |
| SCHEMBL21342424 | 0.87 | ALDH1A1 (0.47) | PDE4BALDH1A1GPR119STSEPHX2 | |
| SCHEMBL21335089 | 0.87 | DPP4 (0.42) | PDE4BALDH1A1GPR119FPR1DPP4 | |
| SCHEMBL21341946 | 0.87 | DPP4 (0.42) | PDE4BALDH1A1GPR119FPR1DPP4 | |
| SCHEMBL23062474 | 0.85 | PDE4B (0.42) | PDE4BALDH1A1GPR119DPP4HTT | |
| SCHEMBL21342337 | 0.84 | YAP1 (0.43) | PDE4BGPR119STSHTTUSP30 | |
| SCHEMBL23062607 | 0.81 | ALDH1A1 (0.55) | PDE4BALDH1A1GPR119STSHTT | |
| SCHEMBL23062606 | 0.81 | ALDH1A1 (0.55) | PDE4BALDH1A1GPR119STSHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019170904-A1 | PIPERIDINES OR PIPERIDONES SUBSTITUTED WITH UREA AND PHENYL | Grünenthal GmbH (DE) | 2019-09-12 | — | — | WO | disclosed |