Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 14/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | PKLR | P30613 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2957622 | 0.89 | HTR2A (0.42) | KCNH2HTR2AHTR2CHTR6HTR1A | |
| SCHEMBL13240503 | 0.85 | HTR2A (0.39) | KCNH2HTR2AHTR2CHTR6HTR1A | |
| SCHEMBL2953292 | 0.84 | HTR2A (0.39) | KCNH2HTR2AHTR2CHTR6HTR1A | |
| SCHEMBL2952107 | 0.81 | HTR6 (0.40) | KCNH2HTR2AHTR6HTR1ADRD2 | |
| SCHEMBL2952104 | 0.80 | HTR6 (0.47) | KCNH2HTR2AHTR6DRD2HTR7 | |
| Hydrochloric Acid SCHEMBL2963663 | 0.80 | HTR6 (0.46) | KCNH2HTR2AHTR6DRD2HTR7 | |
| SCHEMBL2963683 | 0.73 | HTR6 (0.49) | HTR6PKMPKLR | |
| SCHEMBL2953919 | 0.73 | HTR6 (0.44) | HTR6PKMPKLR | |
| SCHEMBL2953515 | 0.71 | HTR6 (0.48) | HTR6PKMPKLR | |
| SCHEMBL2960638 | 0.71 | HTR6 (0.53) | HTR6 |
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-1831191-B1 | CHROMAN DERIVATIVES AND THEIR USE AS 5-HT RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2008-05-21 | — | — | EP | disclosed |