Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 4/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20170493 | 0.83 | CYP11B2 (0.35) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL16720941 | 0.81 | ALDH1A1 (0.42) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL16730969 | 0.78 | IDO1 (0.38) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL18128805 | 0.77 | CYP11B2 (0.46) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL16730886 | 0.77 | CYP11B2 (0.46) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL20170510 | 0.73 | CYP11B2 (0.42) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL16730887 | 0.73 | IDO1 (0.42) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL20162457 | 0.73 | IDO1 (0.42) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL18128796 | 0.72 | CYP11B2 (0.41) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 | |
| SCHEMBL16719057 | 0.72 | CYP11B2 (0.41) | CYP11B2IDO1CYP3A4CYP2D6CYP2B6 |
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 |