Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 16/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8319125 | 0.80 | HTR3A (0.52) | HTR3AKCNH2CYP3A4 | |
| SCHEMBL9705203 | 0.80 | HTR3A (0.53) | HTR3A | |
| SCHEMBL8319129 | 0.80 | HTR3A (0.52) | HTR3AKCNH2CYP3A4 | |
| SCHEMBL8323360 | 0.75 | ALDH1A1 (0.61) | HTR3AKCNH2CYP3A4 | |
| SCHEMBL8323356 | 0.75 | ALDH1A1 (0.61) | HTR3AKCNH2CYP3A4 | |
| SCHEMBL9706213 | 0.70 | HTR3A (0.33) | HTR3AKCNH2 | |
| SCHEMBL8320785 | 0.65 | KCNH2 (0.37) | KCNH2 | |
| SCHEMBL8319559 | 0.65 | KCNH2 (0.62) | HTR3AKCNH2CYP3A4 | |
| SCHEMBL516118 | 0.64 | ALOX5 (0.52) | HDAC1HDAC8HDAC6 | |
| SCHEMBL976167 | 0.64 | HDAC8 (0.59) | HDAC1HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5955470-A | Derivatives of amide analogs of certain methano bridged quinolizines | MERRELL PHARMACEUTICALS, INC. (US) | 1999-09-21 | — | — | US | disclosed |