Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 11/20 | 0.69 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.69 |
| ▸ | CES2 | O00748 | 1/20 | 0.61 |
| ▸ | CES1 | P23141 | 1/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.57 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.51 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.51 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28623180 | 1.00 | HDAC6 (0.69) | HDAC6HDAC1CES2CES1HDAC8 | |
| SCHEMBL17786805 | 0.83 | HDAC6 (0.65) | HDAC6HDAC1HDAC8HDAC3HDAC11 | |
| SCHEMBL28815880 | 0.82 | HDAC6 (1.00) | HDAC6HDAC1HDAC8HDAC3HDAC11 | |
| SCHEMBL13485779 | 0.82 | HDAC6 (0.58) | HDAC6HDAC1HDAC8KCNQ3KCNQ2 | |
| SCHEMBL29717191 | 0.81 | CES2 (0.59) | HDAC6HDAC1CES2CES1KCNQ3 | |
| SCHEMBL4919189 | 0.81 | CES2 (0.59) | HDAC6HDAC1CES2CES1KCNQ3 | |
| SCHEMBL1128282 | 0.81 | CES2 (0.59) | HDAC6HDAC1CES2CES1KCNQ3 | |
| SCHEMBL30147734 | 0.81 | CES2 (0.59) | HDAC6HDAC1CES2CES1HDAC8 | |
| SCHEMBL531941 | 0.81 | CES2 (0.59) | HDAC6HDAC1CES2CES1HDAC8 | |
| SCHEMBL25215904 | 0.79 | HDAC6 (0.59) | HDAC6HDAC1HDAC8HDAC3HDAC11 |
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-118084819-A | Thiazole derivative and application thereof in treatment of leukemia | 华东师范大学 | 2024-05-28 | — | — | CN | disclosed |