Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | UTRN | P46939 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 10/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 5/20 | 0.43 |
| ▸ | CEPT1 | Q9Y6K0 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22660296 | 1.00 | HDAC6 (0.47) | HDAC6HDAC3HDAC8UTRNMAPT | |
| SCHEMBL29469506 | 0.91 | UTRN (0.44) | HDAC6HDAC3HDAC8UTRNMAPT | |
| SCHEMBL22660291 | 0.91 | UTRN (0.44) | HDAC6HDAC3HDAC8UTRNMAPT | |
| SCHEMBL22674259 | 0.87 | AGPAT2 (0.53) | MAPTPOLBTP53RAB9AKDM4E | |
| SCHEMBL29783182 | 0.87 | AGPAT2 (0.53) | MAPTPOLBTP53RAB9AKDM4E | |
| SCHEMBL22660268 | 0.87 | MAPT (0.48) | HDAC6HDAC3HDAC8UTRNMAPT | |
| SCHEMBL29783280 | 0.87 | MAPT (0.48) | HDAC6HDAC3HDAC8UTRNMAPT | |
| SCHEMBL22660246 | 0.85 | MAPT (0.53) | MAPTPOLBTP53RAB9AKDM4E | |
| SCHEMBL29469479 | 0.85 | MAPT (0.53) | MAPTPOLBTP53RAB9AKDM4E | |
| SCHEMBL29469472 | 0.82 | HDAC6 (0.47) | HDAC6HDAC3HDAC8UTRNMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114206443-B | Aromatic or heteroaromatic ring derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-114206443-A | Aromatic ring or heteroaromatic ring derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2022-03-18 | — | — | CN | disclosed |