Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 13/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.61 |
| ▸ | AKT1 | P31749 | 1/20 | 0.53 |
| ▸ | AKT2 | P31751 | 1/20 | 0.53 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.53 |
| ▸ | MC4R | P32245 | 2/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | SPR | P35270 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29868239 | 0.84 | HDAC8 (0.67) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL4774443 | 0.79 | HDAC8 (0.61) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL29868117 | 0.79 | MC4R (0.58) | MC4R | |
| SCHEMBL29868385 | 0.78 | HDAC8 (0.59) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL29868386 | 0.78 | HDAC8 (0.59) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL29868228 | 0.78 | HDAC8 (0.65) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL4778422 | 0.78 | HDAC8 (0.59) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL4902706 | 0.77 | HDAC8 (0.56) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL4795360 | 0.77 | HDAC8 (0.56) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL4779058 | 0.76 | HDAC8 (1.00) | HDAC8HDAC1HDAC3HDAC2HDAC6 |
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-2022178544-A1 | NOVEL HETEROCYCLIC COMPOUNDS AND RELATED METHODS OF MANUFACTURE AND USE IN HDAC INHIBITION | KLOTHO THERAPEUTICS, INC. (US) | 2022-08-25 | — | — | WO | disclosed |