Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.59 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | TOP2A | P11388 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL2404883 | 0.88 | HDAC6 (0.63) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2404885 | 0.88 | HDAC6 (0.63) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2403223 | 0.87 | HDAC6 (0.76) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2403216 | 0.87 | HDAC6 (0.76) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2404957 | 0.85 | HDAC6 (0.57) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2402966 | 0.80 | HDAC1 (0.62) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2402959 | 0.80 | HDAC1 (0.62) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL15029094 | 0.79 | HDAC6 (0.72) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL20683130 | 0.77 | HDAC6 (0.69) | HDAC6HDAC3HDAC1HDAC8HDAC5 | |
| SCHEMBL2406270 | 0.76 | HDAC6 (0.61) | HDAC6HDAC3HDAC1HDAC8HDAC5 |
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-2010043953-A2 | NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2010-04-22 | — | — | WO | disclosed |