Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.76 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.76 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MLNR | O43193 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17079000 | 1.00 | HDAC1 (0.76) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL17078964 | 0.89 | HDAC1 (0.59) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL20421164 | 0.88 | HDAC1 (0.58) | HDAC1HDAC6PTGDR2SIGMAR1MEN1 | |
| SCHEMBL17078628 | 0.88 | HDAC1 (0.61) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL20432854 | 0.88 | HDAC1 (0.58) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL17078680 | 0.88 | HDAC1 (0.58) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL20421030 | 0.88 | HDAC1 (0.58) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL17078815 | 0.88 | HDAC1 (0.58) | HDAC1HDAC6PTGDR2SIGMAR1MEN1 | |
| SCHEMBL17086805 | 0.87 | HDAC1 (0.68) | HDAC1HDAC6PTGDR2HDAC4KCNH2 | |
| SCHEMBL17078972 | 0.86 | HDAC6 (0.56) | HDAC1HDAC6HDAC4KCNH2HDAC8 |
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 |