Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXA2R | P21731 | 4/20 | 0.38 |
| ▸ | PTGDR | Q13258 | 4/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20634793 | 0.74 | HDAC6 (0.43) | TBXA2RPTGDRHDAC6HDAC2HDAC8 | |
| SCHEMBL28476647 | 0.68 | ABCB1 (0.50) | TBXA2RPTGDRHDAC6HDAC2HDAC8 | |
| SCHEMBL28473847 | 0.66 | ABCB1 (0.47) | TBXA2RPTGDRHDAC6HDAC2HDAC8 | |
| SCHEMBL28464322 | 0.63 | HDAC6 (0.49) | TBXA2RPTGDRHDAC6HDAC2HDAC8 | |
| SCHEMBL28471499 | 0.62 | ABCB1 (0.43) | TBXA2RPTGDRHDAC6HDAC2HDAC8 | |
| SCHEMBL20635520 | 0.62 | HDAC6 (0.47) | TBXA2RPTGDRHDAC6HDAC2HDAC8 | |
| SCHEMBL17520626 | 0.61 | HDAC6 (0.59) | HDAC6HDAC2HDAC8HDAC1HDAC10 | |
| SCHEMBL20635550 | 0.59 | — | — | |
| SCHEMBL23718128 | 0.59 | HDAC6 (0.69) | HDAC6HDAC2HDAC8HDAC1HDAC10 | |
| SCHEMBL30148104 | 0.59 | ABCB1 (0.50) | HDAC6HDAC2HDAC8HDAC1HDAC10 |
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-3424925-A1 | NOVEL HDAC6 INHIBITORS, WITH IMPROVED SOLUBILITY AND THEIR USES | Universität Regensburg (DE) | 2019-01-09 | — | — | EP | disclosed |