Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA4 | P22748 | 4/20 | 0.48 |
| ▸ | CA9 | Q16790 | 4/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.47 |
| ▸ | SMO | Q99835 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20432707 | 0.88 | HDAC1 (0.57) | HDAC1CA1CA2CA9HDAC6 | |
| SCHEMBL20432705 | 0.88 | HDAC1 (0.57) | HDAC1CA1CA2CA9HDAC6 | |
| SCHEMBL17086802 | 0.85 | KMT2A (0.49) | HDAC1HDAC4KCNH2HDAC6 | |
| SCHEMBL17078904 | 0.85 | HDAC1 (0.59) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| Hydrochloric Acid SCHEMBL31587034 | 0.84 | MEN1 (0.59) | CA1CA2CA4CA9SMO | |
| SCHEMBL20432768 | 0.84 | HDAC1 (0.70) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL17078445 | 0.81 | HDAC6 (0.60) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL17086801 | 0.81 | HDAC1 (0.47) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL20432720 | 0.80 | HDAC1 (0.50) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL20432868 | 0.78 | HDAC6 (0.42) | HDAC1HDAC4KCNH2HDAC6HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015137750-A1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2015-09-17 | — | — | WO | disclosed |