Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 11/20 | 0.40 |
| ▸ | BCHE | P06276 | 10/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | COMT | P21964 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19014910 | 0.86 | ACHE (0.42) | ACHEBCHECHRM2CHRM1COMT | |
| SCHEMBL29642857 | 0.83 | COMT (0.57) | ACHEBCHECHRM2CHRM1COMT | |
| SCHEMBL20590974 | 0.83 | COMT (0.57) | ACHEBCHECHRM2CHRM1COMT | |
| SCHEMBL31514941 | 0.75 | COMT (0.43) | ACHEBCHECHRM2CHRM1COMT | |
| SCHEMBL19014995 | 0.72 | COMT (0.46) | ACHEBCHECOMTLMNAMAPT | |
| SCHEMBL19015264 | 0.69 | COMT (0.47) | ACHEBCHECOMTLMNAHCRTR1 | |
| SCHEMBL29642900 | 0.67 | COMT (0.70) | ACHEBCHECOMTLMNAMAPT | |
| SCHEMBL18987262 | 0.67 | COMT (0.70) | ACHEBCHECOMTLMNAMAPT | |
| SCHEMBL29642820 | 0.66 | COMT (0.69) | ACHEBCHECOMT | |
| SCHEMBL18987018 | 0.66 | COMT (0.69) | ACHEBCHECOMT |
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-2017103278-A1 | NOVEL BICYCLIC-COMPOUNDS FOR USE AS A MEDICAMENT, IN PARTICULAR FOR TREATMENT OF PARKINSON'S DISEASE | CAPROTEC BIOANALYTICS GMBH (DE) | 2017-06-22 | — | — | WO | disclosed |