Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 4/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 2/20 | 0.33 |
| ▸ | FNTA | P49354 | 2/20 | 0.33 |
| ▸ | FNTB | P49356 | 2/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22729725 | 0.88 | APP (0.37) | MAPTSMN1; SMN2MGLLAPPTACR1 | |
| SCHEMBL22755266 | 0.85 | MGLL (0.41) | MAPTSMN1; SMN2MGLLAPPHSD11B1 | |
| SCHEMBL22754893 | 0.83 | MGLL (0.39) | MGLLHSD11B1GAA | |
| SCHEMBL22729651 | 0.80 | SMN1; SMN2 (0.35) | MAPTSMN1; SMN2APPHSD11B1FNTA | |
| SCHEMBL29839352 | 0.80 | SMN1; SMN2 (0.35) | MAPTSMN1; SMN2APPHSD11B1FNTA | |
| SCHEMBL22755348 | 0.80 | CNR1 (0.34) | HSD11B1CNR2 | |
| SCHEMBL22729718 | 0.78 | ALDH1A1 (0.39) | MAPTSMN1; SMN2MGLLAPPHTT | |
| SCHEMBL29839372 | 0.78 | ALDH1A1 (0.39) | MAPTSMN1; SMN2MGLLAPPHTT | |
| SCHEMBL22755139 | 0.77 | MGLL (0.39) | MAPTMGLLHSD11B1HTTGAA | |
| SCHEMBL22755030 | 0.77 | MGLL (0.41) | MAPTSMN1; SMN2MGLLAPPHSD11B1 |
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-3747885-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2020-12-09 | — | — | EP | disclosed |