Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 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 | |
|---|---|---|---|---|
| SCHEMBL28409337 | 0.86 | MAPT (0.40) | SMN1; SMN2MAPTNPC1TP53RAB9A | |
| SCHEMBL28890966 | 0.84 | EBP (0.34) | MAPTALDH1A1L3MBTL1KMT2ASLC6A2 | |
| SCHEMBL28417336 | 0.83 | MTNR1A (0.41) | SMN1; SMN2MAPTNPC1TP53RAB9A | |
| SCHEMBL28413739 | 0.83 | MAPT (0.40) | SMN1; SMN2MAPTNPC1TP53RAB9A | |
| SCHEMBL28415259 | 0.79 | MAPT (0.36) | SMN1; SMN2MAPTNPC1TP53RAB9A | |
| SCHEMBL28409339 | 0.77 | MAPT (0.43) | SMN1; SMN2MAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL28417337 | 0.77 | CES1 (0.34) | CHRM2SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL28421653 | 0.75 | ICMT (0.37) | MAPTNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL28891502 | 0.74 | NPC1 (0.32) | SMN1; SMN2MAPTNPC1TP53RAB9A | |
| SCHEMBL28412225 | 0.73 | CHRM2 (0.41) | CHRM2MAPTALDH1A1HTR1AADRA1D |
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-111303065-B | N- (arylaminoethyl) -3, 1-benzoxazine-2-ketone compound and preparation method and application thereof | 湖南科技大学 | 2021-11-16 | — | — | CN | disclosed |
| CN-111303065-A | N- (arylaminoethyl) -3, 1-benzoxazine-2-ketone compound and preparation method and application thereof | 湖南科技大学 | 2020-06-19 | — | — | CN | disclosed |