Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 18/20 | 0.54 |
| ▸ | ACACA | Q13085 | 13/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3497534 | 0.93 | ACACB (0.61) | ACACBACACACHEK1 | |
| SCHEMBL13312666 | 0.92 | ACACB (0.51) | ACACBACACA | |
| SCHEMBL3496883 | 0.91 | ACACB (0.63) | ACACBACACA | |
| SCHEMBL3495496 | 0.89 | ACACB (0.61) | ACACBACACA | |
| SCHEMBL4723871 | 0.89 | ACACB (0.56) | ACACBACACACHEK1 | |
| SCHEMBL4723603 | 0.88 | ACACB (0.56) | ACACBACACA | |
| SCHEMBL4724720 | 0.88 | ACACB (0.57) | ACACBACACA | |
| SCHEMBL13312360 | 0.87 | ACACB (0.56) | ACACBACACACHEK1 | |
| SCHEMBL4722169 | 0.86 | ACACB (0.53) | ACACBACACA | |
| SCHEMBL3495867 | 0.86 | ACACB (0.52) | ACACBACACAKDM4EALDH1A1 |
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-1911753-A1 | SPIRO-CYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-04-16 | — | — | EP | disclosed |