Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21486400 | 1.00 | MAPT (0.37) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL23393391 | 0.87 | HTT (0.41) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL23409077 | 0.87 | HTT (0.41) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL23393390 | 0.87 | HTT (0.41) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL21486407 | 0.85 | MAPT (0.41) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL30070748 | 0.85 | MAPT (0.41) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL21483114 | 0.84 | ABCB1 (0.38) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL30070838 | 0.84 | ABCB1 (0.38) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL23409079 | 0.81 | KMT2A (0.46) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 | |
| SCHEMBL30070888 | 0.81 | KMT2A (0.46) | MAPTSMN1; SMN2HTTLMNAL3MBTL1 |
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-110372571-B | 2- (2, 2-diarylethyl) -cyclic amine derivative or salt, synthesis and application thereof, and composition | 中国科学院大连化学物理研究所 | 2022-11-15 | — | — | CN | disclosed |