Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8586535 | 0.76 | HTT (0.39) | HTTCYP1A2CYP2C19 | |
| SCHEMBL28564255 | 0.75 | LMNA (0.42) | HTTCYP1A2CYP2C19HDAC6 | |
| SCHEMBL7525831 | 0.72 | MTNR1A (0.46) | MTNR1A | |
| SCHEMBL9568576 | 0.70 | HTT (0.38) | HTTCYP1A2CYP2C19 | |
| SCHEMBL776507 | 0.70 | HTT (0.39) | HTTCYP1A2CYP2C19 | |
| SCHEMBL9615906 | 0.69 | HTT (0.43) | HTT | |
| SCHEMBL4687102 | 0.68 | SLC6A2 (0.47) | — | |
| SCHEMBL8813449 | 0.68 | LMNA (0.43) | HTTCYP2C19 | |
| SCHEMBL600325 | 0.68 | ALDH1A1 (0.36) | HTT | |
| SCHEMBL2074919 | 0.67 | HTT (0.35) | HTTCYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0873993-B1 | Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2002-02-20 | — | — | EP | disclosed |