Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.44 |
| ▸ | MMP1 | P03956 | 4/20 | 0.44 |
| ▸ | MMP2 | P08253 | 4/20 | 0.44 |
| ▸ | MMP9 | P14780 | 4/20 | 0.44 |
| ▸ | EGFR | P00533 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28296308 | 0.80 | MEN1 (0.42) | MAOBSMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL28296315 | 0.78 | MAOB (0.41) | MAOBMMP1MMP2MMP9EGFR | |
| SCHEMBL28576262 | 0.75 | MEN1 (0.61) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL28294692 | 0.72 | MEN1 (0.39) | MAOBSMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL27876530 | 0.71 | TRPA1 (0.60) | NFE2L2SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL28411059 | 0.70 | CYP2D6 (0.50) | NFE2L2SMN1; SMN2ALDH1A1RAB9AMEN1 | |
| SCHEMBL28411058 | 0.70 | CYP2D6 (0.50) | NFE2L2SMN1; SMN2ALDH1A1RAB9AMEN1 | |
| SCHEMBL28296313 | 0.70 | CYP2D6 (0.50) | NFE2L2SMN1; SMN2ALDH1A1RAB9AMEN1 | |
| SCHEMBL9474707 | 0.70 | ALOX5 (0.62) | NFE2L2SMN1; SMN2ALDH1A1RAB9AMEN1 | |
| SCHEMBL9473335 | 0.70 | ALOX5 (0.62) | NFE2L2SMN1; SMN2ALDH1A1RAB9AMEN1 |
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-109796372-A | A method of preparing polysubstituted alkenyl amidine | 中国科学院化学研究所 | 2019-05-24 | — | — | CN | disclosed |