Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.53 |
| ▸ | GSK3B | P49841 | 4/20 | 0.50 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.49 |
| ▸ | JUN | P05412 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 3/20 | 0.46 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL24433950 | 0.79 | HDAC1 (0.67) | HDAC1HDAC2HDAC8GSK3BPSMB5 | |
| SCHEMBL17503185 | 0.79 | PSMB5 (0.73) | HDAC1HDAC2HDAC8GSK3BPSMB5 | |
| SCHEMBL10061378 | 0.79 | PSMB5 (0.73) | HDAC1HDAC2HDAC8GSK3BPSMB5 | |
| SCHEMBL6535433 | 0.77 | KDM4E (0.57) | PSMB5JUNNFKB1TOP2AKDM4E | |
| SCHEMBL10061374 | 0.76 | HDAC1 (0.50) | HDAC1HDAC2HDAC8GSK3BPSMB5 | |
| Dimethylcurcumin SCHEMBL29354872 | 0.75 | HDAC1 (0.78) | HDAC1HDAC2HDAC8GSK3BJUN | |
| Dimethylcurcumin SCHEMBL3487103 | 0.75 | HDAC1 (0.78) | HDAC1HDAC2HDAC8GSK3BJUN | |
| Dimethylcurcumin SCHEMBL3686107 | 0.75 | HDAC1 (0.78) | HDAC1HDAC2HDAC8GSK3BJUN | |
| Dimethylcurcumin SCHEMBL3487105 | 0.75 | HDAC1 (0.78) | HDAC1HDAC2HDAC8GSK3BJUN | |
| SCHEMBL20585522 | 0.74 | JUN (0.82) | HDAC1HDAC2HDAC8GSK3BJUN |
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-2017096450-A1 | NEW COMPOUNDS WITH ANTIOXIDANT AND ANTIAGING ACTIVITY | EMS S/A (BR) | 2017-06-15 | — | — | WO | disclosed |