Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ACACA | Q13085 | 4/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL3494625 | 0.80 | ACACB (0.47) | ACACBALDH1A1HPGDACACA | |
| SCHEMBL13636599 | 0.78 | ACACB (0.49) | ACACBALDH1A1HPGDACACAKDM4E | |
| SCHEMBL2212213 | 0.75 | TP53 (0.51) | ACACBALDH1A1HPGDACACAKDM4E | |
| SCHEMBL13969593 | 0.75 | HPGD (0.54) | ACACBALDH1A1HPGDKDM4EGAA | |
| SCHEMBL3494073 | 0.74 | ACACB (0.43) | ACACBALDH1A1HPGDACACAKDM4E | |
| SCHEMBL3491850 | 0.74 | ACACB (0.45) | ACACBALDH1A1HPGDACACAKDM4E | |
| SCHEMBL3494054 | 0.73 | KDM4E (0.49) | ACACBALDH1A1HPGDACACAKDM4E | |
| SCHEMBL3492059 | 0.73 | EPHX2 (0.48) | ACACB | |
| SCHEMBL3494495 | 0.72 | ACACB (0.51) | ACACBACACA | |
| SCHEMBL3491156 | 0.71 | ALDH1A1 (0.47) | ACACBALDH1A1HPGDACACAKDM4E |
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-2123652-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2009-11-25 | — | — | EP | disclosed |