Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | UBE2N | P61088 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9603648 | 0.79 | ALDH1A1 (0.45) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL18559615 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL19513573 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL9227794 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL3443068 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL5322903 | 0.75 | ALDH1A1 (0.49) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL9227674 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL18635879 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL18559449 | 0.75 | NR1I2 (0.46) | MAPTPOLBALDH1A1NAAACYP2D6 | |
| SCHEMBL24919973 | 0.74 | MAPT (0.44) | MAPTPOLBALDH1A1NAAACYP2D6 |
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-108484487-B | Antibacterial (methyl) acrylate monomer containing quaternary pyridinium salt and carbamate structure and preparation method and application thereof | 华南理工大学 | 2021-10-22 | — | — | CN | disclosed |