Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.59 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.56 |
| ▸ | HTR3B | O95264 | 3/20 | 0.56 |
| ▸ | HTR3A | P46098 | 3/20 | 0.56 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.56 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.56 |
| ▸ | PLAU | P00749 | 2/20 | 0.56 |
| ▸ | NOS1 | P29475 | 6/20 | 0.47 |
| ▸ | NOS3 | P29474 | 4/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | ACR | P10323 | 1/20 | 0.47 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.45 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8398110 | 0.93 | MEN1 (0.66) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| SCHEMBL28216626 | 0.81 | KMT2A (0.59) | MEN1KMT2ACYP2D6HIF1AHTR3E | |
| SCHEMBL24662980 | 0.80 | KMT2A (1.00) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| SCHEMBL139363 | 0.80 | KMT2A (1.00) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| SCHEMBL24136574 | 0.80 | KMT2A (1.00) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| SCHEMBL4863419 | 0.79 | NOS1 (0.56) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| SCHEMBL13819189 | 0.79 | HTR3E (0.47) | GRIN2BHTR3EHTR3BHTR3AHTR3D | |
| Hydrochloric Acid SCHEMBL28549744 | 0.78 | KMT2A (0.95) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| Hydrochloric Acid SCHEMBL9773794 | 0.78 | KMT2A (0.95) | MEN1KMT2ACYP2D6HIF1AGRIN2B | |
| SCHEMBL5594042 | 0.77 | AKR1C3 (0.50) | KMT2AGRIN2BHTR3EHTR3BHTR3A |
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 |