Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tetrabuthylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | TACR2 | P21452 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.47 |
| ▸ | TST | Q16762 | 1/20 | 0.47 |
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 SCHEMBL6750374 | 0.83 | LMNA (0.47) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| Tetrabuthylammonium SCHEMBL29130294 | 0.81 | TRPV1 (0.46) | ESR1PTGS2TRPV1POLBESR2 | |
| Tetrabuthylammonium SCHEMBL29130225 | 0.81 | LMNA (0.48) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| Tetrabuthylammonium SCHEMBL29130246 | 0.81 | HSD17B3 (0.49) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| Tetrabuthylammonium SCHEMBL29130206 | 0.80 | KIF11 (0.43) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| Tetrabuthylammonium SCHEMBL29130235 | 0.80 | CA12 (0.47) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| Tetrabuthylammonium SCHEMBL28664981 | 0.80 | SLC7A5 (0.60) | ADORA3HSD17B10HIF1AKDM4EEGFR | |
| 4-Octylphenol SCHEMBL7640100 | 0.77 | ESR1 (0.76) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| Sulfuric Acid SCHEMBL5935174 | 0.77 | ESR1 (0.76) | ESR1ALDH1A1LMNAADRA2AADORA3 | |
| 4-Nonylphenol SCHEMBL5935181 | 0.77 | ESR1 (0.76) | ESR1ALDH1A1LMNAADRA2AADORA3 |
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-117164505-A | Method for synthesizing organic sulfate by dialkyl sulfate or pyrosulfate | 湖南大学 | 2023-12-05 | — | — | CN | disclosed |