Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.54 |
| ▸ | DRD4 | P21917 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 4/20 | 0.48 |
| ▸ | BCHE | P06276 | 2/20 | 0.48 |
| ▸ | UBE2M | P61081 | 1/20 | 0.47 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28361503 | 0.84 | ACHE (0.69) | ACHEKMT2AALDH1A1CYP2A13DRD4 | |
| SCHEMBL28829928 | 0.84 | SIGMAR1 (0.57) | ACHEKMT2AALDH1A1CYP2A13BACE1 | |
| SCHEMBL28829847 | 0.84 | CXCR4 (0.60) | ACHEKMT2AALDH1A1CYP2A13DRD4 | |
| Hydrochloric Acid SCHEMBL6647192 | 0.82 | SIGMAR1 (0.56) | ACHEKMT2ABACE1BCHEPOLB | |
| SCHEMBL15026727 | 0.81 | ACHE (0.71) | ACHEKMT2ABACE1BCHEPOLB | |
| SCHEMBL2498286 | 0.80 | ACHE (0.73) | ACHEKMT2ABACE1BCHEPOLB | |
| SCHEMBL12013922 | 0.79 | ACHE (1.00) | ACHEKMT2AALDH1A1CYP2A13DRD4 | |
| Hydrochloric Acid SCHEMBL2766858 | 0.78 | ACHE (0.71) | ACHEKMT2ABACE1BCHEPOLB | |
| SCHEMBL6941873 | 0.78 | ACHE (0.73) | ACHEKMT2AALDH1A1CYP2A13DRD4 | |
| SCHEMBL8107673 | 0.78 | ACHE (0.73) | ACHEKMT2AALDH1A1CYP2A13DRD4 |
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-A | Pyrano-carbazole alkaloid derivative and application thereof in treating Alzheimer's disease | 中国医学科学院药物研究所 | 2022-07-01 | — | — | CN | disclosed |