Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 5/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.38 |
| ▸ | PRCP | P42785 | 4/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.34 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.34 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | AVPR1B | P47901 | 2/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20162426 | 0.84 | CYP11B1 (0.36) | CYP11B1CYP11B2PRCPHSP90AA1HSP90AB1 | |
| SCHEMBL20162427 | 0.72 | CYP11B1 (0.36) | CYP11B1CYP11B2PRCPHSP90AA1HSP90AB1 | |
| SCHEMBL16719039 | 0.70 | FKBP1A (0.42) | AVPR1B | |
| SCHEMBL16720932 | 0.69 | RIPK1 (0.39) | PRCPAPP | |
| SCHEMBL16718979 | 0.68 | CYP11B2 (0.39) | CYP11B1CYP11B2DRD2 | |
| SCHEMBL16730950 | 0.67 | GRM5 (0.44) | CYP11B1CYP11B2PRCP | |
| SCHEMBL16719063 | 0.65 | GRM5 (0.42) | PRCP | |
| SCHEMBL16730951 | 0.64 | KDM4E (0.47) | — | |
| SCHEMBL15358328 | 0.63 | CYP11B1 (0.54) | CYP11B1CYP11B2HSP90AA1HSP90AB1 | |
| SCHEMBL20162457 | 0.63 | IDO1 (0.42) | CYP11B1CYP11B2PRCP |
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 | claimed |