Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PLEC | Q15149 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10598252 | 0.83 | GFER (0.42) | MEN1KMT2AMAPTALDH1A1HTT | |
| SCHEMBL28681170 | 0.81 | LMNA (0.48) | CHRM2MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL28682891 | 0.81 | MEN1 (0.44) | CHRM2MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL445629 | 0.80 | MAPT (0.48) | CHRM2MEN1KMT2AMAPTKDM4E | |
| SCHEMBL28697826 | 0.78 | ALDH1A1 (0.50) | CHRM2MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL29350809 | 0.76 | ACHE (0.44) | KDM4EALDH1A1HPGDALOX15MAPK1 | |
| SCHEMBL28699713 | 0.76 | ACHE (0.44) | KDM4EALDH1A1HPGDALOX15MAPK1 | |
| SCHEMBL515532 | 0.76 | SMN1; SMN2 (0.46) | CHRM2MEN1KMT2AMAPTKDM4E | |
| SCHEMBL28367390 | 0.75 | KMT2A (0.56) | MEN1KMT2AMAPTKDM4EALDH1A1 | |
| SCHEMBL29350760 | 0.72 | TSHR (0.49) | MEN1KMT2AALDH1A1HPGDGAA |
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-113956182-B | HDAC/MAO-B dual inhibitor and preparation and application thereof | 杭州师范大学 | 2023-11-17 | — | — | CN | disclosed |
| CN-113956182-A | HDAC/MAO-B dual inhibitor and preparation and application thereof | 杭州师范大学 | 2022-01-21 | — | — | CN | disclosed |