Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 5/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29425659 | 1.00 | HDAC1 (0.45) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL29425660 | 0.96 | HDAC1 (0.46) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL28713375 | 0.96 | HDAC1 (0.46) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL28709459 | 0.87 | ICMT (0.41) | HDAC1HDAC6HDAC3HDAC2HDAC10 | |
| SCHEMBL28709464 | 0.87 | HDAC1 (0.43) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL29425667 | 0.87 | HDAC1 (0.43) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL28715746 | 0.85 | HPGD (0.48) | HDAC3CNR2 | |
| SCHEMBL28706584 | 0.83 | CASP3 (0.39) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL28703134 | 0.81 | HPGD (0.46) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL28936752 | 0.81 | HDAC1 (0.53) | HDAC1HDAC6HDAC3HDAC4HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114213307-A | Preparation method of N-alkyl substituted pyrrolidone compound | 河南农业大学 | 2022-03-22 | — | — | CN | disclosed |