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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | UQCRB | P14927 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.41 |
| ▸ | PTGES | O14684 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
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 SCHEMBL29130293 | 0.92 | MMP3 (0.47) | TRPV1ESR1MMP3BCL2L1UQCRB | |
| Tetrabuthylammonium SCHEMBL29130272 | 0.82 | ALDH1A1 (0.49) | TRPV1ESR1BCL2L1PTGS2 | |
| Tetrabuthylammonium SCHEMBL29130238 | 0.81 | ESR1 (0.47) | TRPV1ESR1POLBPTGS2ESR2 | |
| Tetrabuthylammonium SCHEMBL6750374 | 0.81 | LMNA (0.47) | ESR1PTGS2 | |
| Tetrabuthylammonium SCHEMBL28976384 | 0.80 | SLC22A1 (0.52) | ESR1PTGS2 | |
| Tetrabuthylammonium SCHEMBL28252771 | 0.80 | SLC22A1 (0.52) | ESR1PTGS2 | |
| Tetrabuthylammonium SCHEMBL623145 | 0.80 | SLC22A1 (0.52) | ESR1PTGS2 | |
| Tetrabuthylammonium SCHEMBL5574983 | 0.80 | SLC22A1 (0.57) | — | |
| Tetrabuthylammonium SCHEMBL5571715 | 0.79 | KCNH2 (0.45) | PTGS2 | |
| Tetrabuthylammonium SCHEMBL29130225 | 0.79 | LMNA (0.48) | ESR1UQCRBPTGS2HDAC3HDAC1 |
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 |