Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.31 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL417979 | 0.80 | NPSR1 (0.37) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL912170 | 0.78 | ALDH1A1 (0.40) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL5529311 | 0.76 | NPSR1 (0.41) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL8166868 | 0.76 | NPSR1 (0.37) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL9781917 | 0.76 | ALDH1A1 (0.40) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL4971017 | 0.76 | FAAH (0.39) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL10969223 | 0.75 | ITGB1 (0.35) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL22515797 | 0.74 | FAAH (0.36) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL30016924 | 0.73 | NPSR1 (0.36) | NPSR1ALDH1A1POLBFAAHNAAA | |
| SCHEMBL11076055 | 0.72 | FAAH (0.46) | NPSR1ALDH1A1POLBFAAHNAAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110759911-B | Carboline derivative, preparation method thereof and application thereof in preventing and treating plant viruses, killing bacteria and killing insects | 南开大学 | 2022-05-24 | — | — | CN | claimed |
| CN-110759911-B | Carboline derivative, preparation method thereof and application thereof in preventing and treating plant viruses, killing bacteria and killing insects | 南开大学 | 2022-05-24 | — | — | CN | disclosed |