Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | LYN | P07948 | 3/20 | 0.32 |
| ▸ | SRC | P12931 | 3/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 3/20 | 0.32 |
| ▸ | BRD4 | O60885 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 2/20 | 0.31 |
| ▸ | CCND1 | P24385 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29093832 | 0.92 | HTR2A (0.34) | HTR2AHTR2CCHRM2CHRM1CHRM3 | |
| SCHEMBL29094005 | 0.89 | HTR2A (0.35) | HTR2AHTR2CLYNSRCADORA2A | |
| SCHEMBL29093827 | 0.83 | BTK (0.41) | LYNSRCADORA2APDE4AADORA2B | |
| SCHEMBL29094009 | 0.83 | KMO (0.40) | ADORA2APDE4AADORA2BPDE4BPDE4C | |
| SCHEMBL27780825 | 0.83 | PLK1 (0.40) | HTR2AHTR2CLYNSRCBTK | |
| SCHEMBL29093828 | 0.83 | HDAC1 (0.39) | HDAC1HDAC6CCR2 | |
| SCHEMBL29093825 | 0.80 | ALDH1A1 (0.35) | ADORA2APDE4AADORA2BPDE4BPDE4C | |
| SCHEMBL29093857 | 0.76 | KMO (0.40) | — | |
| SCHEMBL29093861 | 0.76 | BTK (0.40) | LYNBTKMAPT | |
| SCHEMBL29093829 | 0.76 | KMO (0.39) | ADORA2ABTKHDAC1HDAC6ADORA1 |
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-115572300-A | Synthesis method of sulfonamide substituted polycyclic quinazolinone compound | 江苏理工学院 | 2023-01-06 | — | — | CN | disclosed |