Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | TACR2 | P21452 | 3/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21430237 | 0.94 | HDAC3 (0.48) | HDAC8HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL21428930 | 0.90 | TACR2 (0.48) | HDAC8HDAC3HDAC1TACR2 | |
| SCHEMBL21429011 | 0.90 | TACR2 (0.48) | HDAC8HDAC3HDAC1TACR2 | |
| SCHEMBL25901393 | 0.89 | HDAC3 (0.44) | HDAC8HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL22928996 | 0.86 | TACR2 (0.40) | HDAC8TACR2 | |
| SCHEMBL21430235 | 0.86 | HDAC8 (0.46) | HDAC8HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL25904215 | 0.81 | HDAC8 (0.43) | HDAC8HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL21428942 | 0.78 | HDAC8 (0.46) | HDAC8HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL29407147 | 0.75 | — | — | |
| SCHEMBL29536296 | 0.75 | — | — |
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-2019186174-A1 | MACROCYCLIZATION OF PEPTIDOMIMETICS | UNIVERSITY OF WARWICK (GB) | 2019-10-03 | — | — | WO | disclosed |