Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | HPGD | P15428 | 7/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL27548378 | 0.83 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL23222214 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL1204120 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL10408793 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL31267447 | 0.81 | ALDH1A1 (0.68) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL4922153 | 0.80 | HTT (0.62) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL30827780 | 0.80 | HTT (0.62) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL4914527 | 0.78 | ALDH1A1 (0.57) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL27522005 | 0.78 | ALDH1A1 (0.58) | ALDH1A1HPGDKDM4ESMN1; SMN2LMNA | |
| SCHEMBL866062 | 0.77 | ALDH1A1 (0.64) | ALDH1A1HPGDKDM4EHSD17B10TP53 |
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-1271726-A | 2-amino-N-[2-[[2-(sulfonate group) ethyl] sulfonyl] ethyl] benzoylamine and its preparing process | HUADONG SCIENCE & ENGINEERING (CN) | 2000-11-01 | — | — | CN | disclosed |