Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.41 |
| ▸ | HTR3B | O95264 | 2/20 | 0.41 |
| ▸ | HTR3A | P46098 | 2/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.41 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.41 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.41 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 6/20 | 0.40 |
| ▸ | NOS3 | P29474 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL366630 | 0.74 | CES1 (0.41) | KMT2AMEN1LMNAALOX15CYP2C19 | |
| SCHEMBL24662980 | 0.72 | KMT2A (1.00) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| SCHEMBL139363 | 0.72 | KMT2A (1.00) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| SCHEMBL24136574 | 0.72 | KMT2A (1.00) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| SCHEMBL11033760 | 0.72 | KMT2A (0.55) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| Hydrochloric Acid SCHEMBL9773794 | 0.70 | KMT2A (0.95) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| Hydrochloric Acid SCHEMBL28549744 | 0.70 | KMT2A (0.95) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| SCHEMBL11033759 | 0.69 | KMT2A (0.52) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| Hydrochloric Acid SCHEMBL9156571 | 0.68 | KMT2A (0.55) | KMT2AMEN1CYP2D6HIF1AHTR3E | |
| SCHEMBL28296397 | 0.68 | CYP2D6 (0.56) | KMT2AMEN1CYP2D6HIF1AHTR3E |
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-B | Method for preparing polysubstituted alkenyl amidine | 中国科学院化学研究所 | 2020-03-10 | — | — | CN | disclosed |