Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 13/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ABHD6 | Q9BV23 | 5/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 4/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19785591 | 0.88 | ALDH1A1 (0.44) | MGLLALDH1A1KDM4EPOLBABHD6 | |
| SCHEMBL19785787 | 0.86 | MGLL (0.41) | MGLLALDH1A1KDM4EPOLBABHD6 | |
| SCHEMBL19785596 | 0.83 | FGFR1 (0.45) | MGLLALDH1A1KDM4EPOLB | |
| SCHEMBL29613551 | 0.82 | PTGDR2 (0.38) | MGLL | |
| SCHEMBL19785781 | 0.82 | PTGDR2 (0.38) | MGLL | |
| SCHEMBL19785975 | 0.76 | L3MBTL1 (0.58) | ALDH1A1KDM4EMTNR1B | |
| SCHEMBL22383774 | 0.74 | MGLL (0.34) | MGLLALDH1A1KDM4EPOLBABHD6 | |
| SCHEMBL19786041 | 0.74 | SMN1; SMN2 (0.46) | ALDH1A1KDM4EPOLB | |
| SCHEMBL19785619 | 0.73 | SMN1; SMN2 (0.40) | MGLLALDH1A1KDM4EPOLB | |
| SCHEMBL19785970 | 0.73 | CTSB (0.45) | MGLLALDH1A1KDM4EABHD6PLA2G7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018011201-A1 | HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA | LEO PHARMA A/S (DK) | 2018-01-18 | — | — | WO | disclosed |