Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 9/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.57 |
| ▸ | KMO | O15229 | 1/20 | 0.53 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | BLK | P51451 | 1/20 | 0.48 |
| ▸ | BTK | Q06187 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.48 |
| ▸ | AXL | P30530 | 1/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.48 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.48 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.48 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27754689 | 0.90 | HDAC1 (0.58) | HDAC1ABCB1HDAC3HDAC2MKNK1 | |
| SCHEMBL4579819 | 0.81 | HDAC1 (0.84) | HDAC1ABCB1HDAC3HDAC2 | |
| SCHEMBL27775560 | 0.75 | HDAC1 (0.58) | HDAC1HDAC3HDAC2ALDH1A1MAPT | |
| SCHEMBL7587070 | 0.75 | HDAC1 (0.65) | HDAC1ABCB1HDAC3HDAC2ALDH1A1 | |
| SCHEMBL1399704 | 0.75 | KMO (0.67) | HDAC1ABCB1HDAC3HDAC2KMO | |
| SCHEMBL28125557 | 0.74 | ALDH1A1 (0.54) | HDAC1HDAC3HDAC2ALDH1A1TP53 | |
| SCHEMBL4578711 | 0.74 | HDAC1 (0.84) | HDAC1ABCB1HDAC3HDAC2 | |
| SCHEMBL27754673 | 0.73 | HDAC1 (0.52) | HDAC1HDAC3HDAC2MAPT | |
| SCHEMBL28096618 | 0.73 | KMO (0.69) | ABCB1KMOSIRT2ALDH1A1MAPT | |
| SCHEMBL13188259 | 0.73 | KMO (0.69) | HDAC1ABCB1HDAC3HDAC2KMO |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101466670-B | Inhibitors of histone deacetylase | METHYLGENE INC | 2013-04-17 | — | — | CN | claimed |
| CN-101466670-B | Inhibitors of histone deacetylase | METHYLGENE INC | 2013-04-17 | — | — | CN | disclosed |
| CN-101466670-A | Benzamide derivatives as inhibitors of histone deacetylase | METHYLGENE INC (CA) | 2009-06-24 | — | — | CN | disclosed |