Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.55 |
| ▸ | PLAU | P00749 | 2/20 | 0.53 |
| ▸ | PLG | P00747 | 1/20 | 0.51 |
| ▸ | PLAT | P00750 | 1/20 | 0.51 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.51 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.51 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1206261 | 0.89 | HDAC6 (0.59) | HDAC6HDAC8HDAC3HDAC4HDAC1 | |
| SCHEMBL28927060 | 0.87 | NPC1 (0.65) | HDAC6HDAC8HDAC3HDAC4HDAC1 | |
| SCHEMBL28654116 | 0.86 | HDAC8 (0.61) | HDAC6HDAC8POLBBCHERAB9A | |
| SCHEMBL24892329 | 0.84 | PLAU (0.69) | HDAC6HDAC3PLAUPLGPLAT | |
| SCHEMBL28248363 | 0.83 | NPC1 (0.68) | HDAC6HDAC8BCHERAB9AKDM4E | |
| SCHEMBL28197185 | 0.83 | PLAU (0.60) | HDAC6HDAC3PLAUPLGPLAT | |
| SCHEMBL506399 | 0.80 | NPC1 (0.73) | HDAC6HDAC3PLAUPLGPLAT | |
| SCHEMBL28288605 | 0.80 | NPC1 (0.73) | HDAC6HDAC3PLAUPLGPLAT | |
| SCHEMBL28245532 | 0.80 | PLAU (0.60) | HDAC6HDAC3PLAUPLGPLAT | |
| SCHEMBL6582716 | 0.80 | HDAC6 (0.75) | HDAC6HDAC8HDAC1KDM4EMEN1 |
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-108623537-A | The aromatic amine acetylcholinesterase inhibitor of amine-containing base side chain synthesizes and purposes | 中南大学 | 2018-10-09 | — | — | CN | disclosed |