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 | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 SCHEMBL29130245 | 0.82 | ALDH1A1 (0.37) | PTGS2CA2CA12CA1CA4 | |
| Tetrabuthylammonium SCHEMBL29130264 | 0.81 | TDP1 (0.39) | CA2CA12CA1CA4CA6 | |
| SCHEMBL96651 | 0.80 | PTGS2 (0.68) | PTGS2CA2CA12CA1CA4 | |
| Tetrabuthylammonium SCHEMBL29130238 | 0.75 | ESR1 (0.47) | PTGS2CA2LMNACYP2D6CYP2C9 | |
| SCHEMBL5893459 | 0.75 | PTGS2 (0.72) | PTGS2CA2CA12CA1CA4 | |
| Tetrabuthylammonium SCHEMBL243898 | 0.74 | SLC22A1 (0.67) | TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL14018319 | 0.73 | CA2 (0.70) | PTGS2CA2CA12CA1CA9 | |
| Tetrabuthylammonium SCHEMBL5574983 | 0.72 | SLC22A1 (0.57) | LMNACYP2D6CYP2C9TSHRCYP2C19 | |
| Tetrabuthylammonium SCHEMBL9237587 | 0.72 | LMNA (0.68) | PTGS2CA2CA12CA1CA9 | |
| Tetrabuthylammonium SCHEMBL9795123 | 0.72 | SLC22A1 (0.63) | TSHRHIF1ASMN1; SMN2 |
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 |