Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.57 |
| ▸ | ACACA | Q13085 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.41 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.41 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4302569 | 0.94 | CHEK1 (0.57) | ACACBACACAHPGDCHEK1ABCC1 | |
| SCHEMBL4297853 | 0.92 | ACACB (0.54) | ACACBACACAHPGDCHEK1ABCC1 | |
| SCHEMBL13609469 | 0.90 | ACACB (0.52) | ACACBACACAHPGDCHEK1ABCC1 | |
| SCHEMBL4289630 | 0.87 | ACACB (0.60) | ACACBACACAHPGDKDM4ELMNA | |
| SCHEMBL4293983 | 0.83 | ACACB (0.57) | ACACBACACACHEK1ABCC1KDM4E | |
| SCHEMBL4290207 | 0.83 | ACACB (0.55) | ACACBACACAHPGDKDM4ELMNA | |
| SCHEMBL4294377 | 0.79 | ACACB (0.52) | ACACBACACACHEK1ABCC1MEN1 | |
| SCHEMBL4294112 | 0.77 | CHEK1 (0.56) | ACACBACACACHEK1ABCC1MEN1 | |
| SCHEMBL6184046 | 0.76 | ACACB (0.66) | ACACBACACAKDM4ELMNAALDH1A1 | |
| SCHEMBL6183974 | 0.76 | ACACB (0.78) | ACACBACACAHPGDKDM4ELMNA |
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-2009011-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-12-31 | — | — | EP | disclosed |