Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL6899991 | 0.72 | ALOX5 (0.47) | ALOX5L3MBTL1NQO2HTR2AERBB2 | |
| SCHEMBL5270482 | 0.70 | HTR2A (0.56) | L3MBTL1NQO2HTR2AERBB2CYP1A2 | |
| SCHEMBL1370743 | 0.69 | ALOX5 (0.50) | ALOX5L3MBTL1NQO2HTR2AERBB2 | |
| SCHEMBL18123645 | 0.66 | ALOX5 (0.52) | ALOX5ERBB2CYP1A2FYNMAOA | |
| SCHEMBL28010056 | 0.66 | TDP1 (0.37) | CYP1A2 | |
| SCHEMBL27810981 | 0.66 | CYP2A6 (0.36) | ALOX5L3MBTL1NQO2HTR2AERBB2 | |
| SCHEMBL27950152 | 0.66 | ALOX5 (0.59) | ALOX5L3MBTL1NQO2HTR2AERBB2 | |
| SCHEMBL18123658 | 0.65 | ALOX5 (0.50) | ALOX5L3MBTL1NQO2HTR2AERBB2 | |
| SCHEMBL15064083 | 0.65 | TDP1 (0.39) | — | |
| SCHEMBL31255706 | 0.65 | ALOX5 (0.55) | ALOX5L3MBTL1NQO2HTR2ACYP1A2 |
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-102161646-A | Stilbene derivative with 1,3,4-oxadiazole and preparation method and application thereof | UNIV SOUTH CHINA TECH | 2011-08-24 | — | — | CN | disclosed |