Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 10/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | CTRC | Q99895 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM5A | P29375 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | NOS2 | P35228 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10878832 | 0.86 | AR (0.45) | ARTRPV4CYP2A6 | |
| SCHEMBL11514426 | 0.82 | CYP2A6 (0.35) | ARTRPV4KDM4EALDH1A1LMNA | |
| SCHEMBL28574963 | 0.78 | AR (0.36) | ARTRPV4KDM4EALDH1A1LMNA | |
| SCHEMBL28571188 | 0.77 | PGR (0.33) | ARKDM4EALDH1A1LMNAKDM5A | |
| SCHEMBL12763627 | 0.77 | AR (0.50) | AR | |
| SCHEMBL28571837 | 0.76 | TRPV4 (0.44) | ARTRPV4KDM4EGAAVCAM1 | |
| SCHEMBL28200532 | 0.76 | AR (0.41) | ARTRPV4CTRCKDM4EALDH1A1 | |
| SCHEMBL18552713 | 0.76 | AR (0.44) | ARVCAM1 | |
| SCHEMBL31352954 | 0.74 | KDM4E (0.33) | ARKDM4EALDH1A1LMNAKDM5A | |
| SCHEMBL12763867 | 0.74 | KDM5A (0.36) | ARKDM4EALDH1A1LMNAKDM5A |
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 |