Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL29219438 | 0.86 | KCNH2 (0.48) | ALDH1A1MAOAMAOBAPPPDE5A | |
| SCHEMBL10729581 | 0.83 | KMT2A (0.45) | ALDH1A1MAOAMAOBKMT2AMEN1 | |
| SCHEMBL6089983 | 0.83 | KMT2A (0.48) | ALDH1A1MAOAMAOBKMT2AMEN1 | |
| SCHEMBL29518259 | 0.81 | MAOA (0.45) | ALDH1A1MAOAMAOBKMT2AMEN1 | |
| SCHEMBL18740731 | 0.81 | MAOA (0.45) | ALDH1A1MAOAMAOBKMT2AMEN1 | |
| SCHEMBL9315070 | 0.81 | MAOA (0.45) | ALDH1A1MAOAMAOBKMT2AELANE | |
| SCHEMBL28589683 | 0.81 | CYP1A2 (0.58) | ALDH1A1KMT2AMEN1L3MBTL1KDM4E | |
| SCHEMBL3564800 | 0.81 | MAOA (0.45) | ALDH1A1MAOAMAOBKMT2AMEN1 | |
| SCHEMBL28203119 | 0.80 | NCF1 (0.53) | ALDH1A1MAOAKMT2AMEN1ELANE | |
| SCHEMBL3457284 | 0.79 | APP (0.48) | MAOBKMT2AMEN1APPPDE5A |
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-117945995-A | Alkylated nitrogen-containing heterocyclic compound and preparation method and application thereof | 中国科学院青海盐湖研究所 | 2024-04-30 | — | — | CN | disclosed |