Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 15/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 15/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3470026 | 0.91 | HDAC1 (0.51) | HDAC1HDAC3HDAC2HDAC4HDAC7 | |
| SCHEMBL3467438 | 0.90 | HDAC6 (0.51) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL7919740 | 0.86 | HDAC1 (0.53) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL3467318 | 0.83 | HDAC1 (0.51) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL3468107 | 0.83 | HDAC1 (0.54) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL7912215 | 0.82 | HDAC1 (0.49) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL3472191 | 0.81 | HDAC1 (0.47) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL3466721 | 0.81 | HDAC1 (0.48) | HDAC1HDAC3HDAC2HDAC4HDAC7 | |
| SCHEMBL3467021 | 0.81 | CNR1 (0.48) | HDAC1HDAC3TP53SMN1; SMN2HDAC2 | |
| SCHEMBL3467081 | 0.80 | HDAC1 (0.50) | HDAC1HDAC3HDAC2HDAC4HDAC7 |
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-2010073078-A2 | HETEROCYCLIC COMPOUNDS AS HDAC INHIBITORS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2010-07-01 | — | — | WO | disclosed |