Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30619674 | 0.84 | CYP2A13 (0.56) | KMT2ACYP2A13ALDH1A1KDM4EMEN1 | |
| SCHEMBL30619676 | 0.84 | CXCR4 (0.64) | KMT2ACYP2A13ALDH1A1KDM4ECXCR4 | |
| SCHEMBL6941873 | 0.81 | ACHE (0.73) | ACHEKMT2ACYP2A13ALDH1A1LMNA | |
| SCHEMBL8107673 | 0.81 | ACHE (0.73) | ACHEKMT2ACYP2A13ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL8786449 | 0.80 | ACHE (0.71) | ACHEKMT2ACYP2A13ALDH1A1LMNA | |
| SCHEMBL4636684 | 0.80 | ACHE (0.62) | ACHELMNADRD4DRD2 | |
| SCHEMBL12013922 | 0.79 | ACHE (1.00) | ACHEKMT2ACYP2A13ALDH1A1LMNA | |
| SCHEMBL29767426 | 0.78 | CXCR4 (0.69) | ACHEKMT2ACYP2A13ALDH1A1LMNA | |
| SCHEMBL28829907 | 0.76 | ACHE (0.65) | ACHEKMT2ACYP2A13ALDH1A1LMNA | |
| SCHEMBL15933910 | 0.76 | ACHE (0.65) | ACHEKMT2ACYP2A13ALDH1A1LMNA |
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-114685519-B | Pyranocarbazole alkaloid derivatives and application thereof in treating Alzheimer's disease | 中国医学科学院药物研究所 | 2023-09-26 | — | — | CN | disclosed |