Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | HRH1 | P35367 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HPN | P05981 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | HRH2 | P25021 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4778352 | 0.90 | ALDH1A1 (0.40) | CYP3A4HRH1USP2CYP1A2CYP2D6 | |
| SCHEMBL4778576 | 0.84 | FAAH (0.47) | KCNH2ALDH1A1KDM4ELMNA | |
| SCHEMBL4775561 | 0.83 | MAPT (0.43) | KCNH2MEN1KMT2AGAAMAPT | |
| SCHEMBL4778381 | 0.78 | LSS (0.40) | CYP3A4MEN1KMT2ASIGMAR1 | |
| SCHEMBL4773088 | 0.77 | SIGMAR1 (0.36) | CNR1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL4771297 | 0.75 | NPSR1 (0.46) | USP2CYP2C19ALDH1A1KDM4EMEN1 | |
| SCHEMBL4776514 | 0.74 | SIGMAR1 (0.36) | CYP3A4ALDH1A1KDM4ESIGMAR1 | |
| SCHEMBL21299953 | 0.72 | CYP3A4 (0.51) | CYP3A4HRH1USP2CYP1A2CYP2D6 | |
| SCHEMBL20415963 | 0.72 | ALDH1A1 (0.83) | CYP3A4HRH1USP2CYP1A2CYP2D6 | |
| SCHEMBL4774991 | 0.72 | LMNA (0.39) | CYP3A4CYP1A2CYP2D6CYP2C19HTR2A |
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-1996550-A2 | CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES | Novartis AG (CH) | 2008-12-03 | — | — | EP | disclosed |
| WO-2007038459-A2 | CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES | NOVARTIS AG (CH) | 2007-04-05 | — | — | WO | disclosed |