Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 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 | |
|---|---|---|---|---|
| SCHEMBL8320578 | 0.87 | MAPT (0.47) | THRBATMMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL8319501 | 0.79 | THRB (0.54) | THRBATMMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL8323871 | 0.77 | HDAC2 (0.55) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| SCHEMBL8318679 | 0.77 | HDAC1 (0.53) | THRBATMMAPTESR1HDAC3 | |
| SCHEMBL8322757 | 0.76 | RNASEH1 (0.52) | THRBATMMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL7967988 | 0.74 | THRB (0.89) | THRBATMMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL7967986 | 0.74 | THRB (0.89) | THRBATMMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL12473720 | 0.74 | THRB (0.89) | THRBATMMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL28723584 | 0.73 | THRB (0.76) | THRBATMMAPTALDH1A1GSK3B | |
| 4-Methoxycinnamic Acid SCHEMBL58700 | 0.72 | THRB (1.00) | THRBATMMAPTALDH1A1SMN1; SMN2 |
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 |