Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 4/20 | 0.86 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.58 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
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 SCHEMBL28186302 | 1.00 | SLC22A1 (0.86) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL28128597 | 0.97 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL28186303 | 0.97 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL2138786 | 0.97 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL29213158 | 0.96 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL10352758 | 0.96 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL4859378 | 0.96 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL1204718 | 0.96 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL3414877 | 0.96 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL5687676 | 0.96 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 |
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 93 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483225-A | A kind of water phase Suzuki cross-coupling reaction of the palladium chtalyst without additional ligand | UNIV SHAANXI NORMAL | 2019-11-22 | — | — | CN | claimed |
| CN-110418834-A | post-CMP cleaning composition | YOUNG CHANG CHEMICAL CO LTD | 2019-11-05 | — | — | CN | claimed |
| CN-109775718-A | A kind of modified Y-Y isomorphous molecular sieve and its preparation method and application | 中国石油化工股份有限公司 | 2019-05-21 | — | — | CN | claimed |
| CN-109775716-A | A kind of multi-stage porous Y type molecular sieve and preparation method thereof rich in L acid | 中国石油化工股份有限公司 | 2019-05-21 | — | — | CN | claimed |
| CN-109328218-A | The saturating clear extension content tab of tacky adhesive is removed with selectivity | 艾利丹尼森公司 | 2019-02-12 | — | — | CN | claimed |
| CN-108949141-A | The preparation method of bistable state electrochromic material and it is used to prepare electrochromic device | 常州铱视光电科技有限公司 | 2018-12-07 | — | — | CN | claimed |
| CN-105949377-B | The preparation method of fire-retardant, antibacterial, waterproof water soluble acrylic acid esters resin | 东莞市炬勤光电材料有限公司 | 2018-06-12 | — | — | CN | claimed |
| CN-107935905-A | The synthetic method of Indiacens A | 大理大学 | 2018-04-20 | — | — | CN | claimed |
| CN-105126898-B | The preparation of hydrogenation deoxidation isomerization catalyst and its application in gutter oil prepares diesel oil | 华东师范大学 | 2017-11-24 | — | — | CN | claimed |
| CN-107208007-A | post-CMP formulations and methods of use thereof | 恩特格里斯公司 | 2017-09-26 | — | — | CN | claimed |
| CN-106967419-A | A kind of ternary nano oversubscription sub-light good harvest system of sulfated cyclodextrins phenylenevinylene derivative Nile red and preparation method thereof | 南开大学 | 2017-07-21 | — | — | CN | claimed |
| CN-106103620-A | Selectivity is used to take off the goods of glutinous binder, composition, system and method | 艾利丹尼森公司 | 2016-11-09 | — | — | CN | claimed |
| CN-101880396-B | Preparation method of organic silicon rubber for encapsulating LED being convenient for vacuum defoamation | UNIV HANGZHOU NORMAL | 2011-11-23 | — | — | CN | claimed |
| US-20040019146-A1 | Elastomeric polyurethane fiber with high heat-set efficiency | INVISTA NORTH AMERICA S.A.R.L. (F/K/A ARTEVA NORTH AMERICA S.A.R.L.) | 2004-01-29 | — | — | US | claimed |
| EP-1356144-A1 | ELASTOMERIC POLYURETHANE FIBER WITH HIGH HEAT-SET EFFICIENCY | DuPont-Toray Co. Ltd. (JP) | 2003-10-29 | — | — | EP | claimed |
| WO-2002050349-A1 | ELASTOMERIC POLYURETHANE FIBER WITH HIGH HEAT-SET EFFICIENCY | DUPONT-TORAY COMPANY, LTD (JP) | 2002-06-27 | — | — | WO | claimed |
| CN-110494414-A | α-functionalization ketone preparation method | IGM GROUP BV | 2019-11-22 | — | — | CN | disclosed |
| CN-110494427-A | The simple oxidation of alkylaryl ketone is functionalized | IGM GROUP B V | 2019-11-22 | — | — | CN | disclosed |
| CN-101171230-A | Heterocyclic-substituted alkanamides useful as renin inhibitors | SPEEDEL EXPERIMENTA AG (CH) | 2008-04-30 | — | — | CN | disclosed |
| US-20040019146-A1 | Elastomeric polyurethane fiber with high heat-set efficiency | INVISTA NORTH AMERICA S.A.R.L. (F/K/A ARTEVA NORTH AMERICA S.A.R.L.) | 2004-01-29 | — | — | US | disclosed |