Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19908743 | 0.85 | ALDH1A1 (0.40) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL19908754 | 0.77 | ALPL (0.51) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL19908623 | 0.71 | PTPN1 (0.32) | — | |
| SCHEMBL19908604 | 0.66 | ALPL (0.55) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL23469137 | 0.66 | ALPL (0.43) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL19908562 | 0.64 | ALDH1A1 (0.53) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL13536791 | 0.61 | GRM1 (0.52) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL18686653 | 0.60 | KMT2A (0.43) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL3928222 | 0.60 | ALDH1A1 (0.69) | ALDH1A1GLAMAOBALPLALPG | |
| SCHEMBL11814029 | 0.59 | ALPL (0.53) | ALDH1A1GLAMAOBALPLALPG |
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-3287441-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |