Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2619612 | 0.77 | ALOX5 (0.41) | ADRA1D | |
| SCHEMBL27629534 | 0.77 | KEAP1 (0.32) | — | |
| SCHEMBL27969165 | 0.77 | SLC6A3 (0.38) | — | |
| SCHEMBL27627631 | 0.74 | KEAP1 (0.55) | — | |
| SCHEMBL5147496 | 0.74 | — | — | |
| SCHEMBL27857859 | 0.73 | FFAR4 (0.43) | — | |
| SCHEMBL29953910 | 0.73 | ALDH1A1 (0.44) | — | |
| SCHEMBL29951423 | 0.71 | ALDH1A1 (0.53) | POLB | |
| SCHEMBL2562150 | 0.71 | ADRA1D (0.38) | ADRA1DPOLBPARP1 | |
| SCHEMBL27658638 | 0.70 | ALDH1A1 (0.43) | ADRA1DPOLBPARP1 |
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-105164112-A | Amide compound and preparation method, pharmaceutical composition and application thereof | SHANGHAI INST MATERIA MEDICA | 2015-12-16 | — | — | CN | disclosed |