Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 3/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.37 |
| ▸ | HTR3B | O95264 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28413170 | 1.00 | CYP2D6 (0.46) | CYP2D6HIF1ATTRALOX5PTGS1 | |
| SCHEMBL28413171 | 1.00 | CYP2D6 (0.46) | CYP2D6HIF1ATTRALOX5PTGS1 | |
| SCHEMBL698718 | 0.78 | TTR (0.53) | TTRALOX5PTGS1PTGS2NFE2L2 | |
| SCHEMBL698717 | 0.78 | TTR (0.53) | TTRALOX5PTGS1PTGS2NFE2L2 | |
| SCHEMBL28411059 | 0.77 | CYP2D6 (0.50) | CYP2D6HIF1ATTRALOX5PTGS1 | |
| SCHEMBL28296313 | 0.77 | CYP2D6 (0.50) | CYP2D6HIF1ATTRALOX5PTGS1 | |
| SCHEMBL28411058 | 0.77 | CYP2D6 (0.50) | CYP2D6HIF1ATTRALOX5PTGS1 | |
| SCHEMBL28524007 | 0.73 | TTR (0.46) | TTRALOX5PTGS1PTGS2MEN1 | |
| SCHEMBL28408255 | 0.72 | MEN1 (0.48) | CYP2D6HIF1AMEN1KMT2ANFE2L2 | |
| SCHEMBL28408254 | 0.72 | MEN1 (0.48) | CYP2D6HIF1AMEN1KMT2ANFE2L2 |
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 |