Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | GLS | O94925 | 3/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | CASP2 | P42575 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28736640 | 0.86 | PKM (0.51) | ALDH1A1CYP3A4TSHRGLSPKM | |
| SCHEMBL28736638 | 0.86 | PKM (0.51) | ALDH1A1CYP3A4TSHRGLSPKM | |
| SCHEMBL10693587 | 0.84 | ALDH1A1 (0.62) | ALDH1A1CYP3A4TSHRPKMSMN1; SMN2 | |
| SCHEMBL4162007 | 0.84 | PKM (0.62) | ALDH1A1CYP3A4TSHRGLSPKM | |
| SCHEMBL4158526 | 0.84 | PKM (0.62) | ALDH1A1CYP3A4TSHRGLSPKM | |
| SCHEMBL4158522 | 0.84 | PKM (0.62) | ALDH1A1CYP3A4TSHRGLSPKM | |
| SCHEMBL12282275 | 0.83 | PKM (0.64) | ALDH1A1GLSPKMSMN1; SMN2LMNA | |
| SCHEMBL18554631 | 0.83 | PKM (0.50) | ALDH1A1CYP3A4TSHRPKMLMNA | |
| SCHEMBL10692448 | 0.82 | POLB (0.59) | ALDH1A1CYP3A4TSHRGLSSMN1; SMN2 | |
| SCHEMBL10693607 | 0.82 | ALDH1A1 (0.51) | ALDH1A1CYP3A4TSHRGLSPKM |
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-0098743-B1 | PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE | Yu, Ruey J., Dr. (US) | 1988-09-28 | — | — | EP | claimed |