Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL106854 | 0.92 | TSHR (0.47) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrabuthylammonium SCHEMBL28316124 | 0.86 | MEN1 (0.51) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrabuthylammonium SCHEMBL28459959 | 0.86 | TSHR (0.42) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrabuthylammonium SCHEMBL106856 | 0.86 | ALDH1A1 (0.47) | CYP3A4LMNAMEN1KMT2ATSHR | |
| Tetrabuthylammonium SCHEMBL19019700 | 0.84 | ALDH1A1 (0.52) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrabuthylammonium SCHEMBL29420045 | 0.84 | ALDH1A1 (0.52) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrabuthylammonium SCHEMBL3702709 | 0.84 | TSHR (0.44) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrylammonium SCHEMBL28894215 | 0.83 | ALDH1A1 (0.42) | CYP3A4LMNAMAPTMEN1NR1I2 | |
| Tetrabuthylammonium SCHEMBL107740 | 0.83 | KDM4E (0.59) | CYP3A4LMNAMAPTMEN1KMT2A | |
| Tetrapropylammonium SCHEMBL105669 | 0.81 | ALDH1A1 (0.45) | CYP3A4LMNAMAPTMEN1NR1I2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110183639-B | Preparation method and application of catalyst for polyester synthesis | 华东理工大学 | 2022-10-11 | — | — | CN | claimed |
| CN-110183639-B | Preparation method and application of catalyst for polyester synthesis | 华东理工大学 | 2022-10-11 | — | — | CN | disclosed |
| CN-113388101-B | Chitosan-loaded carbamoyl quaternary ammonium salt organic micromolecule catalyst and application thereof | 华东理工大学 | 2022-06-17 | — | — | CN | disclosed |
| CN-113388101-A | Chitosan-loaded carbamoyl quaternary ammonium salt organic micromolecule catalyst and application thereof | 华东理工大学 | 2021-09-14 | — | — | CN | disclosed |