Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | |
|---|---|---|---|---|
| ▸ | FKBP5 | Q13451 | 1/20 | 0.53 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.53 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
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 SCHEMBL27764902 | 0.98 | FKBP5 (0.55) | FKBP5CRBNOR51E2SLC22A1ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL27764909 | 0.98 | FKBP5 (0.55) | FKBP5CRBNOR51E2SLC22A1ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL27801924 | 0.97 | FKBP5 (0.53) | FKBP5CRBNOR51E2SLC22A1ALDH1A1 | |
| Caprolactam SCHEMBL6668448 | 0.89 | CRBN (0.67) | FKBP5CRBNOR51E2ALOX5KDM4E | |
| Undecane SCHEMBL3414259 | 0.88 | CRBN (0.64) | FKBP5CRBNOR51E2ALOX5KDM4E | |
| Dodecane SCHEMBL27688625 | 0.88 | CRBN (0.64) | FKBP5CRBNOR51E2ALOX5KDM4E | |
| Dodecane SCHEMBL28204455 | 0.86 | CRBN (0.67) | FKBP5CRBNOR51E2ALOX5KDM4E | |
| Caprolactam SCHEMBL29165574 | 0.84 | CRBN (0.59) | FKBP5CRBNOR51E2ALOX5KDM4E | |
| Caprolactam SCHEMBL28288208 | 0.84 | CRBN (0.59) | FKBP5CRBNOR51E2ALOX5KDM4E | |
| Caprolactam SCHEMBL28189684 | 0.84 | DNM1 (0.50) | FKBP5CRBNOR51E2ALOX5KDM4E |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108816196-B | High-selectivity compound desulfurizer and preparation method thereof | 淄博凯美可工贸有限公司 | 2021-05-14 | — | — | CN | claimed |
| CN-111154549-A | Method for extracting rose essential oil from rose waste residue after extraction of essential oil | 河北科技大学 | 2020-05-15 | — | — | CN | claimed |
| CN-110935306-A | Method for reducing sulfur dioxide content in tail gas by utilizing ionic liquid supergravity desulfurization technology | 山东益丰生化环保股份有限公司 | 2020-03-31 | — | — | CN | claimed |
| CN-108816196-A | Highly selective Compositional type reclaiming agent and preparation method thereof | 淄博凯美可工贸有限公司 | 2018-11-16 | — | — | CN | claimed |
| CN-105797713-B | A kind of preparation method of metal-modified amphibole catalyst | 河北科技大学 | 2018-09-25 | — | — | CN | claimed |
| CN-106442607-A | Method for controlling temperature of glycine cooling crystallization crystal point | 河北科技大学 | 2017-02-22 | — | — | CN | claimed |
| CN-105967968-A | Acetylene purification system and method | 北京神雾环境能源科技集团股份有限公司 | 2016-09-28 | — | — | CN | claimed |
| CN-105797713-A | Preparation method of metal modified amphibole catalyst | 河北科技大学 | 2016-07-27 | — | — | CN | claimed |
| CN-118253166-A | SO in recovered tail gas2Method and system of (2) | 中国石油天然气股份有限公司 | 2024-06-28 | — | — | CN | disclosed |
| CN-118253168-A | SO in recovered tail gas2Method and system of (2) | 中国石油天然气股份有限公司 | 2024-06-28 | — | — | CN | disclosed |
| CN-111154549-B | Method for extracting rose essential oil from rose waste residues after extracting essential oil | 河北科技大学 | 2023-09-01 | — | — | CN | disclosed |
| CN-113877366-B | Composite absorbent and method for selectively removing hydrogen sulfide | 中国石油化工股份有限公司 | 2023-05-02 | — | — | CN | disclosed |
| CN-115970759-A | High-efficiency catalytic oxidation desulfurizer as well as preparation method and application thereof | 中国石油化工股份有限公司 | 2023-04-18 | — | — | CN | disclosed |
| CN-113058419-B | Supported ionic liquid desulfurization material and preparation method and application thereof | 浙江工业大学 | 2023-02-28 | — | — | CN | disclosed |
| CN-105797713-B | A kind of preparation method of metal-modified amphibole catalyst | 河北科技大学 | 2018-09-25 | — | — | CN | disclosed |
| CN-106442607-A | Method for controlling temperature of glycine cooling crystallization crystal point | 河北科技大学 | 2017-02-22 | — | — | CN | disclosed |
| CN-104151466-B | L-phenylalanine green is utilized to prepare the method for new material of detachable chiral binaphthol | 齐鲁工业大学 | 2016-10-26 | — | — | CN | disclosed |
| CN-104151466-B | L-phenylalanine green is utilized to prepare the method for new material of detachable chiral binaphthol | 齐鲁工业大学 | 2016-10-26 | — | — | CN | disclosed |
| CN-105967968-A | Acetylene purification system and method | 北京神雾环境能源科技集团股份有限公司 | 2016-09-28 | — | — | CN | disclosed |
| CN-105797713-A | Preparation method of metal modified amphibole catalyst | 河北科技大学 | 2016-07-27 | — | — | CN | disclosed |