Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22283401 | 0.75 | PPARG (0.47) | ALOX15PPARGPPARAICMT | |
| SCHEMBL17444738 | 0.75 | LMNA (0.44) | RECQLALOX15AKR1C3ALDH1A1ATM | |
| Citronellol SCHEMBL29242937 | 0.73 | ALOX15 (0.55) | ALOX15AKR1C3ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL4621084 | 0.72 | ALOX15 (0.49) | ALOX15ALDH1A1ATMTDP1L3MBTL1 | |
| SCHEMBL3088914 | 0.72 | ALOX15 (0.49) | ALOX15ALDH1A1ATMTDP1TSHR | |
| Citronellol SCHEMBL7576962 | 0.71 | ALOX15 (0.62) | ALOX15ALDH1A1ATMTDP1L3MBTL1 | |
| SCHEMBL8094330 | 0.71 | CYP3A4 (0.54) | RECQLAKR1C3ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL1716809 | 0.71 | CYP3A4 (0.54) | RECQLAKR1C3ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL28053946 | 0.71 | CYP3A4 (0.54) | RECQLAKR1C3ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL3504902 | 0.71 | ALOX15 (0.56) | ALOX15ALDH1A1TDP1NFE2L2LMNA |
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-117586218-A | Chiral octacyclic ether compound and synthetic method and application thereof | 浙江工业大学 | 2024-02-23 | — | — | CN | disclosed |