Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | COMT | P21964 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 4/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2923547 | 0.87 | COMT (0.46) | GAASMN1; SMN2LMNAHSD17B10COMT | |
| SCHEMBL19586255 | 0.86 | GAA (0.47) | GAASMN1; SMN2HDAC6KDM1AALDH1A1 | |
| SCHEMBL28642452 | 0.74 | KDM1A (0.49) | GAASMN1; SMN2LMNAHDAC6KDM1A | |
| SCHEMBL6382726 | 0.74 | HRH4 (0.31) | — | |
| SCHEMBL10074441 | 0.72 | HDAC1 (0.62) | GAATHRBSMN1; SMN2LMNAHDAC6 | |
| SCHEMBL27519383 | 0.71 | HDAC4 (0.71) | SMN1; SMN2LMNAHDAC4HDAC1KCNH2 | |
| SCHEMBL2926205 | 0.70 | COMT (0.37) | COMT | |
| SCHEMBL29275413 | 0.69 | HDAC4 (0.55) | GAATHRBSMN1; SMN2LMNAHDAC6 | |
| SCHEMBL19609092 | 0.69 | KDM1A (0.49) | GAASMN1; SMN2LMNAHDAC6KDM1A | |
| SCHEMBL14217257 | 0.69 | HDAC1 (0.54) | GAATHRBSMN1; SMN2LMNAHDAC6 |
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-109153636-B | Cyclopropyl-amide compounds as dual LSD1/HDAC inhibitors | 朱比连特埃皮科尔有限责任公司 | 2021-10-22 | — | — | CN | disclosed |