Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.36 |
| ▸ | KDM5A | P29375 | 4/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.36 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11514426 | 0.79 | CYP2A6 (0.35) | ARKDM5AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL15427430 | 0.78 | PTGS2 (0.37) | ALDH1A1KDM4EMAPTHPGDL3MBTL1 | |
| SCHEMBL17604488 | 0.77 | KDM4E (0.42) | ARALDH1A1KDM4EIMPDH2IMPDH1 | |
| SCHEMBL14948935 | 0.77 | AR (0.36) | ARALDH1A1KDM4EIMPDH2IMPDH1 | |
| SCHEMBL20231243 | 0.76 | TSHR (0.42) | ARALDH1A1IMPDH2IMPDH1TSHR | |
| SCHEMBL28574963 | 0.76 | AR (0.36) | ARKDM5AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL28571188 | 0.74 | PGR (0.33) | ARKDM5AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL28571834 | 0.74 | ALDH1A1 (0.50) | ARKDM5AKDM4CALDH1A1KDM4E | |
| SCHEMBL28566867 | 0.74 | AR (0.38) | ARKDM5AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL24707377 | 0.72 | MEP1B (0.38) | MAPT |
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-112778215-A | 2-methoxyphenoxy pyrimidine antitumor compound and preparation method and application thereof | 中国医科大学 | 2021-05-11 | — | — | CN | disclosed |