Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL19227576 | 0.84 | HCRTR1 (0.35) | — | |
| SCHEMBL23963612 | 0.71 | NPC1 (0.43) | — | |
| SCHEMBL23963627 | 0.70 | PCSK9 (0.42) | ALDH1A1 | |
| SCHEMBL20189218 | 0.70 | GRIN2B (0.40) | ALDH1A1GRIN2BHRH4 | |
| SCHEMBL20189215 | 0.70 | GRIN2B (0.40) | ALDH1A1GRIN2BHRH4 | |
| SCHEMBL18296935 | 0.70 | GRIN2B (0.40) | ALDH1A1GRIN2BHRH4 | |
| Hydrochloric Acid SCHEMBL18280955 | 0.69 | GRIN2B (0.40) | ALDH1A1GRIN2BHRH4 | |
| Hydrochloric Acid SCHEMBL18281002 | 0.69 | GRIN2B (0.40) | ALDH1A1GRIN2BHRH4 | |
| SCHEMBL1596808 | 0.68 | IDO1 (0.44) | — | |
| SCHEMBL24288112 | 0.68 | MAP4K4 (0.35) | HRH4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3180332-A1 | DIFLUOROPYRROLIDINES AS OREXIN RECEPTOR MODULATORS | Eolas Therapeutics Inc. (US) | 2017-06-21 | — | — | EP | disclosed |
| WO-2016025669-A1 | DIFLUOROPYRROLIDINES AS OREXIN RECEPTOR MODULATORS | EOLAS THERAPEUTICS, INC. (US) | 2016-02-18 | — | — | WO | disclosed |