Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 7/20 | 0.50 |
| ▸ | SNCA | P37840 | 2/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | SLC22A2 | O15244 | 2/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.40 |
| ▸ | SLC22A3 | O75751 | 2/20 | 0.40 |
| ▸ | PLAU | P00749 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28410295 | 1.00 | NFE2L2 (0.50) | NFE2L2SNCAGRIN1GRIN2BMEN1 | |
| SCHEMBL28410294 | 1.00 | NFE2L2 (0.50) | NFE2L2SNCAGRIN1GRIN2BMEN1 | |
| SCHEMBL28408255 | 0.89 | MEN1 (0.48) | NFE2L2MEN1KMT2ASLC22A2SLC22A1 | |
| SCHEMBL28408254 | 0.89 | MEN1 (0.48) | NFE2L2MEN1KMT2ASLC22A2SLC22A1 | |
| SCHEMBL28408256 | 0.89 | MEN1 (0.48) | NFE2L2MEN1KMT2ASLC22A2SLC22A1 | |
| SCHEMBL28410290 | 0.82 | TRPA1 (0.53) | NFE2L2SNCAPTGS1PLAUEGFR | |
| SCHEMBL28410291 | 0.82 | TRPA1 (0.53) | NFE2L2SNCAPTGS1PLAUEGFR | |
| SCHEMBL28296320 | 0.82 | TRPA1 (0.53) | NFE2L2SNCAPTGS1PLAUEGFR | |
| SCHEMBL9797944 | 0.76 | NFE2L2 (0.58) | NFE2L2SNCAMAOAMAOBALDH1A1 | |
| SCHEMBL10496469 | 0.76 | NFE2L2 (0.58) | NFE2L2SNCAMAOAMAOBALDH1A1 |
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-109796372-B | Method for preparing polysubstituted alkenyl amidine | 中国科学院化学研究所 | 2020-03-10 | — | — | CN | disclosed |
| CN-109796372-A | A method of preparing polysubstituted alkenyl amidine | 中国科学院化学研究所 | 2019-05-24 | — | — | CN | disclosed |