Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9430490 | 0.85 | MAOB (0.49) | HDAC6ALDH1A1APPMAOBCA12 | |
| SCHEMBL13699027 | 0.82 | ALDH1A1 (0.44) | HDAC6ALDH1A1APPKDM4EMAPT | |
| SCHEMBL11888137 | 0.78 | HDAC6 (0.56) | HDAC6ALDH1A1KDM4EMAPTMIF | |
| SCHEMBL16901843 | 0.78 | HDAC6 (0.51) | HDAC6ALDH1A1KDM4EMAPTMIF | |
| SCHEMBL19067621 | 0.78 | ALDH1A1 (0.41) | HDAC6ALDH1A1APPKDM4EMAPT | |
| SCHEMBL25762766 | 0.78 | KDM4E (0.46) | HDAC6ALDH1A1APPKDM4EMAPT | |
| SCHEMBL17821417 | 0.77 | HDAC6 (0.58) | HDAC6APPMIFCYP2A6HDAC3 | |
| SCHEMBL17221188 | 0.77 | HDAC6 (0.54) | HDAC6APPMIFHDAC3HDAC1 | |
| SCHEMBL16693060 | 0.77 | HDAC6 (0.54) | HDAC6ALDH1A1APPKDM4EMIF | |
| SCHEMBL30230050 | 0.77 | KDM4E (0.41) | HDAC6ALDH1A1APPKDM4EMAPT |
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-3394052-B1 | BICYCLIC HYDROXAMIC ACIDS USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY | KANCERA AB (SE) | 2021-07-28 | — | — | EP | disclosed |