Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 15/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 12/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.62 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.62 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.62 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.62 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.62 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL23059526 | 0.86 | ALDH1A1 (0.58) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL11719473 | 0.83 | HDAC3 (0.72) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| Hydrochloric Acid SCHEMBL8957362 | 0.81 | HDAC3 (0.70) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL26412435 | 0.80 | TP53 (0.52) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL23059525 | 0.79 | HDAC3 (0.43) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL6699180 | 0.77 | KDM4E (0.59) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL7311864 | 0.77 | TP53 (0.55) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL673705 | 0.77 | HDAC1 (1.00) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL23045052 | 0.76 | POLB (0.56) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL11353314 | 0.76 | RAD52 (0.59) | HDAC3HDAC1HDAC2HDAC8HDAC4 |
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-2021037127-A1 | BENZIMIDAZOLE SUBSTITUTION-BASED PHENYL N-BUTYRAMIDE COMPOUND AND PREPARATION METHOD THEREFOR | 上海特化医药科技有限公司 | 2021-03-04 | — | — | WO | disclosed |