Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4816483 | 0.77 | EGFR (0.53) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL4816488 | 0.77 | EGFR (0.53) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL29082327 | 0.77 | POLB (0.50) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL29082329 | 0.72 | VCP (0.53) | HDAC1HDAC6HTTSMN1; SMN2 | |
| SCHEMBL4815776 | 0.72 | MAPT (0.45) | HTTSMN1; SMN2 | |
| SCHEMBL4813798 | 0.71 | TDP1 (0.47) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL4819147 | 0.71 | HDAC1 (0.56) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL4818285 | 0.71 | SOST (0.59) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL4819669 | 0.71 | ALDH1A1 (0.58) | HDAC1HDAC6HDAC2HDAC8HDAC3 | |
| SCHEMBL6744793 | 0.70 | SMN1; SMN2 (0.59) | HSD17B10HTTCYP2C9SMN1; SMN2 |
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-1656348-B1 | ACETYLENE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE | AXYS PHARM INC (US) | 2007-02-07 | — | — | EP | claimed |