Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 8/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21976490 | 0.92 | SMN1; SMN2 (0.40) | HDAC1HDAC8HDAC6LMNAALDH1A1 | |
| SCHEMBL21976232 | 0.90 | SMPD1 (0.45) | HDAC1HDAC8HDAC6ALDH1A1SMPD1 | |
| SCHEMBL21976248 | 0.87 | HDAC6 (0.45) | HDAC8HDAC6LMNAALDH1A1SMPD1 | |
| SCHEMBL21976229 | 0.75 | GAA (0.46) | HDAC1HDAC8HDAC6ALDH1A1TSHR | |
| SCHEMBL21976306 | 0.73 | HDAC6 (0.47) | HDAC8HDAC6SMPD1MEN1KMT2A | |
| SCHEMBL21976469 | 0.72 | HDAC6 (0.47) | HDAC1HDAC8HDAC6 | |
| SCHEMBL21976208 | 0.72 | PBRM1 (0.44) | HDAC1HDAC8HDAC6 | |
| SCHEMBL21975927 | 0.71 | KDM4E (0.41) | HDAC1HDAC8HDAC6SMPD1 | |
| SCHEMBL21976479 | 0.71 | HDAC6 (0.50) | HDAC1HDAC8HDAC6LMNASMPD1 | |
| SCHEMBL21976492 | 0.70 | SMPD1 (0.53) | HDAC6LMNAALDH1A1SMPD1TSHR |
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-3294715-B1 | BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY | KANCERA AB (SE) | 2020-05-06 | — | — | EP | disclosed |