Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 20/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | HTR1D | P28221 | 2/20 | 0.42 |
| ▸ | HTR1B | P28222 | 2/20 | 0.42 |
| ▸ | HTR1F | P30939 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL3614531 | 0.96 | HTR6 (0.52) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| SCHEMBL3623479 | 0.89 | HTR6 (0.60) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| SCHEMBL3614533 | 0.76 | HTR6 (0.41) | HTR6CYP3A4CYP2D6 | |
| Trifluoroacetic Acid SCHEMBL3620317 | 0.76 | HTR6 (0.60) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| Trifluoroacetic Acid SCHEMBL3620057 | 0.73 | HTR6 (0.53) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| Trifluoroacetic Acid SCHEMBL4019045 | 0.73 | HTR6 (0.57) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| Trifluoroacetic Acid SCHEMBL3621796 | 0.73 | HTR6 (0.57) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| Trifluoroacetic Acid SCHEMBL27750244 | 0.72 | HTR6 (0.52) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| Trifluoroacetic Acid SCHEMBL3617270 | 0.72 | HTR6 (0.68) | HTR6CYP3A4CYP2D6HTR1ADRD2 | |
| Trifluoroacetic Acid SCHEMBL3622703 | 0.72 | HTR6 (0.68) | HTR6CYP3A4CYP2D6HTR1ADRD2 |
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-2046741-A1 | INDOLES AS 5-HT6 MODULATORS | BIOVITRUM AB (publ) (SE) | 2009-04-15 | — | — | EP | disclosed |
| WO-2008003703-A1 | INDOLES AS 5-HT6 MODULATORS | BIOVITRUM AB (PUBL) (SE) | 2008-01-10 | — | — | WO | disclosed |