Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.81 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.81 |
| ▸ | TP53 | P04637 | 1/20 | 0.81 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.48 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11842060 | 0.90 | ALDH1A1 (1.00) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL11597254 | 0.90 | ALDH1A1 (1.00) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL491492 | 0.90 | ALDH1A1 (1.00) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705884 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705885 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL8395652 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL26940074 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL7928146 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705995 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705886 | 0.81 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA |
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-109776782-B | Ionic organic catalyst and preparation method and application thereof | 华南理工大学 | 2021-02-19 | — | — | CN | disclosed |
| CN-109776782-A | A kind of ionic organic catalyst and its preparation method and application | 华南理工大学 | 2019-05-21 | — | — | CN | disclosed |