Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA4 | P22748 | 1/20 | 0.55 |
| ▸ | CES2 | O00748 | 5/20 | 0.54 |
| ▸ | CES1 | P23141 | 5/20 | 0.54 |
| ▸ | NAAA | Q02083 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TAS2R10 | Q9NYW0 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 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 SCHEMBL108878 | 1.00 | CA2 (0.55) | CA2CA4CES2CES1NAAA | |
| Tetrabuthylammonium SCHEMBL8579564 | 0.98 | CA2 (0.53) | CA2CA4CES2CES1NAAA | |
| Tetrabuthylammonium SCHEMBL4636014 | 0.97 | CA2 (0.52) | CA2CA4CES2CES1NAAA | |
| Benzoic Acid SCHEMBL10945582 | 0.97 | CA2 (0.52) | CA2CA4CES2CES1NAAA | |
| Tetrapentylammonium SCHEMBL237498 | 0.96 | CA2 (0.55) | CA2CA4CES2CES1NAAA | |
| Tetrabuthylammonium SCHEMBL8579570 | 0.95 | CES2 (0.50) | CA2CA4CES2CES1NAAA | |
| Benzoic Acid SCHEMBL237507 | 0.95 | CES2 (0.56) | CA2CA4CES2CES1NAAA | |
| Benzoic Acid SCHEMBL238614 | 0.95 | CES2 (0.56) | CA2CA4CES2CES1NAAA | |
| Benzoic Acid SCHEMBL238281 | 0.95 | CES2 (0.56) | CA2CA4CES2CES1NAAA | |
| Tetrahexylammonium SCHEMBL49208 | 0.95 | CES2 (0.56) | CA2CA4CES2CES1NAAA |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117334855-A | Zwitterionic polymer coated silicon carbon material and preparation method and application thereof | 碳一新能源集团有限责任公司 | 2024-01-02 | — | — | CN | claimed |
| CN-114341215-B | Curable composition | 株式会社日本触媒 | 2024-12-27 | — | — | CN | disclosed |
| EP-3805282-B1 | METHOD FOR PRODUCING VINYL-ETHER-GROUP-CONTAINING (METH)ACRYLIC ACID ESTER POLYMER, VINYL-ETHER-GROUP-CONTAINING (METH)ACRYLIC ACID ESTER POLYMER, AND POLYMER COMPOSITION | NIPPON CATALYTIC CHEM IND (JP) | 2024-09-11 | — | — | EP | disclosed |
| CN-117334855-A | Zwitterionic polymer coated silicon carbon material and preparation method and application thereof | 碳一新能源集团有限责任公司 | 2024-01-02 | — | — | CN | disclosed |
| CN-112239520-B | Polymer crosslinking agent, and polymer and composition using same | 信越化学工业株式会社 | 2023-10-03 | — | — | CN | disclosed |
| CN-112218901-B | Vinyl ether group-containing (meth) acrylate polymer, process for producing the same, and polymer composition | 株式会社日本触媒 | 2023-08-25 | — | — | CN | disclosed |
| US-11643490-B2 | Method for producing vinyl-ether-group-containing (meth)acrylic acid ester polymer, vinyl-ether-group-containing (meth)acrylic acid ester polymer, and polymer composition | NIPPON SHOKUBAI CO., LTD. (JP) | 2023-05-09 | — | — | US | disclosed |
| CN-107892729-B | Copolymer of triisopropylsilyl (meth) acrylate and (meth) acrylic acid derivative and process for producing the same | 信越化学工业株式会社 | 2022-09-06 | — | — | CN | disclosed |
| US-20210246245-A1 | METHOD FOR PRODUCING VINYL-ETHER-GROUP-CONTAINING (METH)ACRYLIC ACID ESTER POLYMER, VINYL-ETHER-GROUP-CONTAINING (METH)ACRYLIC ACID ESTER POLYMER, AND POLYMER COMPOSITION | NIPPON SHOKUBAI CO., LTD. (JP) | 2021-08-12 | — | — | US | disclosed |
| EP-3805282-A1 | METHOD FOR PRODUCING VINYL-ETHER-GROUP-CONTAINING (METH)ACRYLIC ACID ESTER POLYMER, VINYL-ETHER-GROUP-CONTAINING (METH)ACRYLIC ACID ESTER POLYMER, AND POLYMER COMPOSITION | Nippon Shokubai Co., Ltd. (JP) | 2021-04-14 | — | — | EP | disclosed |
| WO-2021039799-A1 | CURABLE COMPOSITION | 株式会社日本触媒 | 2021-03-04 | — | — | WO | disclosed |
| WO-2021039801-A1 | CURABLE COMPOSITION | 株式会社日本触媒 | 2021-03-04 | — | — | WO | disclosed |
| CN-112218901-A | Method for producing vinyl ether group-containing (meth) acrylate polymer, and polymer composition | 株式会社日本触媒 | 2021-01-12 | — | — | CN | disclosed |