Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 17/20 | 0.63 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.59 |
| ▸ | MMP1 | P03956 | 3/20 | 0.56 |
| ▸ | MMP2 | P08253 | 3/20 | 0.56 |
| ▸ | MMP9 | P14780 | 3/20 | 0.56 |
| ▸ | EGFR | P00533 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2640602 | 0.88 | HDAC1 (0.66) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL3228591 | 0.88 | EGFR (0.71) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL3228583 | 0.88 | EGFR (0.71) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL7978520 | 0.87 | HDAC1 (0.64) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL8348482 | 0.85 | TRPA1 (0.68) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL4536420 | 0.85 | TRPA1 (0.68) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL4536422 | 0.85 | TRPA1 (0.68) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL13180844 | 0.85 | HDAC1 (0.74) | HDAC1HDAC2MMP1MMP2MMP9 | |
| SCHEMBL1064700 | 0.84 | HDAC1 (0.65) | HDAC1HDAC2 | |
| SCHEMBL1064701 | 0.84 | HDAC1 (0.65) | HDAC1HDAC2 |
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 |