Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | MDH1 | P40925 | 1/20 | 0.50 |
| ▸ | MDH2 | P40926 | 1/20 | 0.50 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28660381 | 0.85 | ALDH1A1 (0.52) | ALDH1A1KDM4EKMT2AMEN1HPGD | |
| SCHEMBL28646395 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KDM4EKMT2AMEN1HPGD | |
| SCHEMBL12388579 | 0.82 | KDM4E (0.54) | ALDH1A1KDM4EKMT2AMEN1MDH1 | |
| Hydrochloric Acid SCHEMBL1580067 | 0.81 | KDM4E (0.53) | ALDH1A1KDM4EKMT2AMEN1MDH1 | |
| SCHEMBL7240816 | 0.80 | MDH1 (0.55) | ALDH1A1KDM4EKMT2AMEN1MDH1 | |
| SCHEMBL31345791 | 0.77 | ALDH1A1 (0.73) | ALDH1A1KDM4EKMT2AMEN1MDH1 | |
| SCHEMBL28648127 | 0.77 | KDM4E (0.50) | ALDH1A1KDM4EKMT2AMEN1HPGD | |
| SCHEMBL12237376 | 0.77 | PDE4B (0.54) | ALDH1A1KDM4EKMT2AMEN1HPGD | |
| SCHEMBL28649485 | 0.76 | MAPT (0.57) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL6266977 | 0.76 | TP53 (0.69) | ALDH1A1KDM4EKMT2AHPGDMAPT |
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-109400625-B | Fused bicyclic compound and application thereof in medicine | 广东东阳光药业有限公司 | 2021-11-12 | — | — | CN | disclosed |