Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.68 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.68 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 2/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3467496 | 0.90 | HDAC1 (0.73) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL3468139 | 0.88 | CNR2 (0.58) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL3477433 | 0.88 | HDAC1 (0.71) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL3466885 | 0.81 | HDAC6 (0.59) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL7919669 | 0.81 | HDAC1 (0.61) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL3467874 | 0.79 | HDAC6 (0.57) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL7912521 | 0.79 | HDAC3 (0.59) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL7919673 | 0.79 | HDAC1 (0.58) | HDAC1HDAC6CNR2 | |
| SCHEMBL3467928 | 0.79 | HDAC1 (0.60) | HDAC1HDAC6CNR2HDAC3HDAC2 | |
| SCHEMBL3467026 | 0.78 | CNR2 (0.51) | HDAC1HDAC6CNR2HDAC3 |
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 |