Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MYC | P01106 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | GHSR | Q92847 | 2/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17078942 | 0.91 | HDAC6 (0.49) | HDAC1HDAC6 | |
| SCHEMBL17078615 | 0.91 | KDM4E (0.37) | HDAC1HDAC6HTTKDM4EALDH1A1 | |
| SCHEMBL20432796 | 0.91 | HDAC6 (0.49) | HDAC1HDAC6 | |
| SCHEMBL20421063 | 0.88 | HDAC1 (0.37) | HDAC1HDAC6SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL20420911 | 0.86 | HDAC6 (0.49) | HDAC1HDAC6CYP2D6CSF1RTBK1 | |
| SCHEMBL20420994 | 0.83 | HDAC1 (0.43) | HDAC1HDAC6SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL20420984 | 0.83 | BRD4 (0.43) | MYCHDAC1HDAC6HSD17B10HTT | |
| SCHEMBL20420924 | 0.80 | GHSR (0.43) | HDAC1HDAC6HSD17B10KDM4EALDH1A1 | |
| SCHEMBL17078940 | 0.79 | HDAC6 (0.49) | HDAC1HDAC6CSF1R | |
| SCHEMBL20432855 | 0.79 | HDAC6 (0.49) | HDAC1HDAC6CSF1R |
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 |
|---|---|---|---|---|---|---|---|
| EP-3116859-B1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-08-01 | — | — | EP | disclosed |