Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.55 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 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 | |
|---|---|---|---|---|
| SCHEMBL9729530 | 0.76 | ALOX5 (0.54) | ALOX5NR1H4CA12CA9KDM4E | |
| SCHEMBL31544361 | 0.76 | ALOX5 (0.54) | ALOX5NR1H4CA12CA9KDM4E | |
| SCHEMBL430257 | 0.76 | ALOX5 (0.51) | ALOX5NR1H4CA12CA9KDM4E | |
| SCHEMBL10470600 | 0.75 | ALOX5 (0.71) | ALOX5NR1H4CA12CA9MAPT | |
| SCHEMBL432850 | 0.75 | ALOX5 (0.71) | ALOX5NR1H4CA12CA9KDM4E | |
| SCHEMBL10702114 | 0.73 | ALOX5 (0.57) | ALOX5NR1H4CA12CA9KDM4E | |
| SCHEMBL30438234 | 0.73 | ALOX5 (0.48) | ALOX5NR1H4CA12CA9KDM4E | |
| SCHEMBL7058640 | 0.73 | PTGS2 (0.51) | ALOX5NR1H4KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL18055910 | 0.72 | ALOX5 (0.53) | ALOX5NR1H4CA12CA9KDM4E | |
| Formamide SCHEMBL9729804 | 0.71 | MTNR1A (0.56) | ALOX5NR1H4CA12CA9KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116478143-A | Donepezil derivative, preparation method and application thereof | 山东第一医科大学(山东省医学科学院) | 2023-07-25 | — | — | CN | claimed |
| CN-116478143-A | Donepezil derivative, preparation method and application thereof | 山东第一医科大学(山东省医学科学院) | 2023-07-25 | — | — | CN | disclosed |