Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL16730970 | 0.81 | TSHR (0.34) | HTR1ADRD2HTR7HTR2A | |
| SCHEMBL16730891 | 0.81 | MEN1 (0.33) | — | |
| SCHEMBL16730892 | 0.79 | OGA (0.35) | — | |
| SCHEMBL16718973 | 0.78 | ADRA2C (0.30) | — | |
| SCHEMBL20169617 | 0.78 | ADRA2C (0.30) | — | |
| SCHEMBL16719028 | 0.74 | SCN9A (0.39) | — | |
| SCHEMBL16718968 | 0.74 | DRD3 (0.35) | DRD2HTR6 | |
| SCHEMBL16719019 | 0.73 | SCN9A (0.31) | — | |
| SCHEMBL16719059 | 0.73 | MGAT2 (0.34) | — | |
| SCHEMBL20170505 | 0.72 | — | — |
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-3068391-B1 | ARYL LINKED IMIDAZOLE AND TRIAZOLE DERIVATIVES AND METHODS OF USE THEREOF FOR IMPROVING THE PHARMACOKINETICS OF A DRUG | MERCK SHARP & DOHME (US) | 2018-05-23 | — | — | EP | disclosed |