Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.48 |
| ▸ | BID | P55957 | 3/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.48 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.48 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 2/20 | 0.48 |
| ▸ | EP300 | Q09472 | 1/20 | 0.48 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.48 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.48 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.48 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28281237 | 0.95 | ALDH1A1 (0.48) | PPARABIDMCL1BCL2L1BAK1 | |
| SCHEMBL28602248 | 0.90 | BID (0.49) | PPARABIDMCL1BCL2L1BAK1 | |
| SCHEMBL28280190 | 0.89 | ALDH1A1 (0.50) | ALDH1A1LMNAHSD17B10CFTRCYP1A2 | |
| SCHEMBL28106654 | 0.84 | ALDH1A1 (0.64) | PPARAALDH1A1LMNAALOX5PTGS2 | |
| SCHEMBL15528607 | 0.84 | ALDH1A1 (0.55) | ALDH1A1LMNAHSD17B10CFTRTSHR | |
| SCHEMBL28942702 | 0.84 | PPARA (0.56) | PPARABIDMCL1BCL2L1BAK1 | |
| SCHEMBL28602250 | 0.83 | ALDH1A1 (0.56) | PPARABIDMCL1BCL2L1BAK1 | |
| SCHEMBL29148965 | 0.83 | ALDH1A1 (0.62) | PPARABIDMCL1BCL2L1BAK1 | |
| SCHEMBL11552750 | 0.83 | ALDH1A1 (0.62) | PPARABIDMCL1BCL2L1BAK1 | |
| SCHEMBL1908423 | 0.83 | BID (0.59) | PPARABIDMCL1BCL2L1BAK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113396145-A | PFKFB3 inhibitors and uses thereof | 盖罗发现有限责任公司 | 2021-09-14 | — | — | CN | disclosed |