Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4150775 | 0.83 | DHODH (0.71) | DHODHCHRNA7CYP2D6 | |
| Desbromoarborescidine A SCHEMBL29002756 | 0.81 | CHRNA7 (0.66) | CHRNA7ADRA1AADRA1DADRA1BCYP2D6 | |
| Desbromoarborescidine A SCHEMBL31662855 | 0.81 | CHRNA7 (0.66) | CHRNA7ADRA1AADRA1DADRA1BCYP2D6 | |
| Desbromoarborescidine A SCHEMBL5269957 | 0.81 | CHRNA7 (0.66) | CHRNA7ADRA1AADRA1DADRA1BCYP2D6 | |
| Desbromoarborescidine A SCHEMBL30363173 | 0.81 | CHRNA7 (0.66) | CHRNA7ADRA1AADRA1DADRA1BCYP2D6 | |
| SCHEMBL29458059 | 0.80 | CHRNA7 (0.64) | CHRNA7ADRA1AADRA1DADRA1BCYP2D6 | |
| SCHEMBL3859034 | 0.80 | CHRNA7 (0.64) | CHRNA7ADRA1AADRA1DADRA1BCYP2D6 | |
| SCHEMBL4161958 | 0.77 | DHODH (0.81) | DHODHCHRNA7CYP2D6 | |
| SCHEMBL30363129 | 0.77 | SIRT1 (0.52) | DHODHCHRNA7 | |
| SCHEMBL30363194 | 0.77 | SIRT1 (0.52) | DHODHCHRNA7 |
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-118515667-A | Method for synthesizing 3,7A-diazacyclohepta [ jk ] fluorene derivative | 山西医科大学 | 2024-08-20 | — | — | CN | disclosed |