Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28922877 | 1.00 | KDM4E (0.38) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL22554261 | 0.79 | DDB1 (0.35) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL30148836 | 0.77 | PTGDR2 (0.46) | — | |
| SCHEMBL16201684 | 0.76 | CDK5 (0.45) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL28922903 | 0.75 | KDM4E (0.35) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL28922829 | 0.71 | PDE4A (0.36) | KDM4EALDH1A1HSD17B10CYP1A2PDE4A | |
| SCHEMBL28922791 | 0.68 | CYP1A2 (0.36) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL30148885 | 0.68 | CYP1A2 (0.36) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL21227272 | 0.67 | L3MBTL1 (0.39) | KDM4EALDH1A1HSD17B10USP2CYP1A2 | |
| SCHEMBL6024550 | 0.67 | HTR2A (0.42) | KDM4EALDH1A1HSD17B10USP2CYP1A2 |
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-115521325-A | Boronic acid derivatives | 首药控股(北京)股份有限公司 | 2022-12-27 | — | — | CN | disclosed |