Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.49 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KDM4A | O75164 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL18688204 | 1.00 | HDAC6 (0.53) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL18688725 | 0.99 | HDAC6 (0.54) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL18688684 | 0.84 | CHRM2 (0.54) | GAAMAPTKMT2ACHRM2CHRM4 | |
| SCHEMBL18688203 | 0.81 | DRD2 (0.56) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL18688370 | 0.77 | HDAC1 (0.51) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL18688206 | 0.76 | HDAC1 (0.52) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL27750482 | 0.74 | HDAC1 (0.56) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL1576678 | 0.71 | HDAC1 (0.58) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL12656475 | 0.70 | HDAC1 (0.57) | HDAC6HDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL20524109 | 0.69 | HDAC6 (1.00) | HDAC6HDAC1HDAC8HDAC3HDAC4 |
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-2017053360-A1 | BICYCLIC AND TRICYCLIC CAP BEARING MERCAPTOACETAMIDE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-03-30 | — | — | WO | disclosed |