Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 11/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 9/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 9/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 8/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 7/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 7/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29908940 | 0.90 | HDAC8 (0.56) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL29908939 | 0.83 | HDAC8 (0.47) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL1066363 | 0.82 | HDAC8 (0.57) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL7109424 | 0.78 | ALDH1A1 (0.59) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL7828619 | 0.78 | ALDH1A1 (0.59) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL29245786 | 0.77 | PAX8 (0.43) | ALDH1A1MAPTNPC1ALOX15MAPK1 | |
| SCHEMBL3460830 | 0.77 | RAB9A (0.54) | ALDH1A1MAPTNPC1NFKB1MAPK1 | |
| Sebacic Acid SCHEMBL3905690 | 0.77 | HDAC8 (0.57) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL7813937 | 0.76 | MAPT (0.69) | HDAC8HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL1163445 | 0.76 | CA1 (0.54) | HDAC8HDAC1HDAC3HDAC2ALDH1A1 |
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-4054607-A1 | SELECTIVE HDAC6 DEGRADERS AND METHODS OF USE THEREOF | Dana-Farber Cancer Institute, Inc. (US) | 2022-09-14 | — | — | EP | disclosed |