Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 16/20 | 0.38 |
| ▸ | TDO2 | P48775 | 9/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16719064 | 0.90 | TDO2 (0.40) | IDO1TDO2CYP3A4 | |
| SCHEMBL16718995 | 0.80 | OGA (0.38) | IDO1TDO2 | |
| SCHEMBL18134516 | 0.75 | OGA (0.37) | IDO1TDO2 | |
| SCHEMBL16719060 | 0.75 | OGA (0.36) | IDO1 | |
| SCHEMBL16719065 | 0.73 | OGA (0.39) | IDO1CYP11B2CYP3A4 | |
| SCHEMBL20170501 | 0.72 | HRH3 (0.34) | IDO1TDO2 | |
| SCHEMBL16718992 | 0.70 | TDO2 (0.33) | IDO1TDO2 | |
| SCHEMBL16720866 | 0.69 | OGA (0.38) | — | |
| SCHEMBL20162418 | 0.69 | IDO1 (0.48) | IDO1TDO2CYP11B2CYP3A4 | |
| SCHEMBL16730871 | 0.69 | PIM1 (0.55) | IDO1TDO2 |
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 |