Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 20/20 | 0.78 |
| ▸ | HTR2A | P28223 | 17/20 | 0.78 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.70 |
| ▸ | HTR2B | P41595 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL8959658 | 0.89 | HTR2C (0.62) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| Fumaric Acid SCHEMBL8959645 | 0.89 | HTR2C (0.62) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL26674202 | 0.88 | HTR2C (0.63) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959516 | 0.88 | HTR2C (1.00) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959582 | 0.88 | HTR2C (1.00) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959641 | 0.85 | HTR2C (0.56) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959629 | 0.85 | HTR2C (0.56) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13970610 | 0.84 | HTR2C (0.80) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8001642 | 0.82 | HTR2C (0.78) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959930 | 0.82 | HTR2C (1.00) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 |
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-0655440-A2 | 1-Aminoethylindoles | F. HOFFMANN-LA ROCHE AG (CH) | 1995-05-31 | — | — | EP | disclosed |