Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 9/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL8323958 | 0.80 | HDAC1 (0.40) | HDAC1HDAC8HDAC6TGFBR1HDAC4 | |
| SCHEMBL8325909 | 0.80 | HDAC4 (0.55) | KDM4AKDM4CHDAC1HDAC8HDAC6 | |
| SCHEMBL1579332 | 0.79 | NPSR1 (0.43) | HDAC1HDAC8HDAC6TGFBR1HDAC4 | |
| SCHEMBL1579334 | 0.79 | NPSR1 (0.43) | HDAC1HDAC8HDAC6TGFBR1HDAC4 | |
| SCHEMBL1164811 | 0.78 | HDAC1 (0.37) | HDAC1HDAC8HDAC6BCHEACHE | |
| SCHEMBL3439472 | 0.78 | HDAC1 (0.37) | HDAC1HDAC8HDAC6BCHEACHE | |
| SCHEMBL8319569 | 0.78 | TGFBR1 (0.44) | HDAC1HDAC8HDAC6TGFBR1HDAC4 | |
| SCHEMBL8318730 | 0.77 | TBXAS1 (0.60) | KDM4AKDM4CTBXAS1CYP2E1CYP3A4 | |
| SCHEMBL4258903 | 0.77 | MGLL (0.46) | HDAC1HDAC8HDAC6HDAC4MGLL | |
| SCHEMBL4258906 | 0.77 | MGLL (0.46) | HDAC1HDAC8HDAC6HDAC4MGLL |
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-2004063169-A1 | HYDROXAMID ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ASTELLAS PHARMA INC. (JP) | 2004-07-29 | — | — | WO | disclosed |