Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 8/20 | 0.47 |
| ▸ | PDE4A | P27815 | 6/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL16117368 | 0.82 | LMNA (0.49) | PDE4APDE4BPDE4CPDE4DMAPK1 | |
| SCHEMBL13219748 | 0.76 | CHRM3 (0.42) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL26890472 | 0.74 | PDE10A (0.50) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14685224 | 0.74 | NPY5R (0.46) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL22616920 | 0.68 | OPRM1 (0.42) | — | |
| SCHEMBL12341499 | 0.67 | HRH4 (0.50) | MAPK1L3MBTL1MEN1KMT2ACYP1A2 | |
| SCHEMBL27741341 | 0.67 | HSD17B10 (0.44) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL15055333 | 0.67 | CHRM3 (0.46) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL26337498 | 0.67 | GBA1 (0.42) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL77166 | 0.66 | LMNA (0.30) | — |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |