Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Decane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.89 |
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 5/20 | 0.89 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Decane SCHEMBL10420748 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Heptane SCHEMBL3417507 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Heptane SCHEMBL1143764 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Octane SCHEMBL9716479 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Octane SCHEMBL9716483 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Heptane SCHEMBL21802129 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Water SCHEMBL4410904 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Nonane SCHEMBL9836650 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Dodecane SCHEMBL6340877 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 | |
| Tetradecane SCHEMBL4356032 | 1.00 | TSHR (0.89) | TSHRTHRBLMNADNM1ALDH1A1 |
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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106645754-B | Photoelectricity immunosensor based on water-soluble Cd-Ag-Te quantum dots/nanogold composite material | 中南民族大学 | 2018-05-08 | — | — | CN | claimed |
| CN-106645754-A | Photoelectric immune sensor based on water-soluble Cd-Ag-Te quantum dot/nano-gold composite materials | 中南民族大学 | 2017-05-10 | — | — | CN | claimed |
| EP-0208215-A2 | Purification of blood clotting factors and other blood proteins on non-carbohydrate sulfated matrices | MILES INC. (US) | 1987-01-14 | — | — | EP | claimed |
| US-11866633-B2 | Lignin composition, methods of making and using the composition for adsorption onto petrochemical oil and oil removal | BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) | 2024-01-09 | — | — | US | disclosed |
| US-11853663-B2 | Monte Carlo molecular simulation method for efficient calculation of the interfacial tension of water/benzene liquid phase by improving Ewald sum | SHENZHEN JINGTAI TECHNOLOGY CO., LTD. (CN) | 2023-12-26 | — | — | US | disclosed |
| CN-111063396-B | Monte Carlo molecular simulation method for calculating water/benzene liquid phase interfacial tension through Ewald sum | 深圳晶泰科技有限公司 | 2023-09-01 | — | — | CN | disclosed |
| CN-110785379-B | Morpholine-based quaternary ammonium cations and AEI-type zeolites prepared therefrom | 赛成公司 | 2022-12-27 | — | — | CN | disclosed |
| US-11530996-B1 | Controlling crystallization at the interface between oil and brine | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2022-12-20 | — | — | US | disclosed |
| US-20220381707-A1 | CONTROLLING CRYSTALLIZATION AT THE INTERFACE BETWEEN OIL AND BRINE | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2022-12-01 | — | — | US | disclosed |
| CN-104756010-B | Photosensitive resin composition, cured product and method for producing the same, method for producing resin pattern, cured film and use thereof | 富士胶片株式会社 | 2019-07-30 | — | — | CN | disclosed |
| CN-110072982-A | Lubricant additive composition comprising phosphorus-containing compound and use thereof | 雅富顿化学公司 | 2019-07-30 | — | — | CN | disclosed |
| CN-106103679-A | Detergent composition exhibiting both cleaning and rinsing functions | 艺康美国股份有限公司 | 2016-11-09 | — | — | CN | disclosed |
| CN-103554107-B | AZAADAMANTANE DERIVATIVES AND METHODS OF USE | 艾伯维巴哈马有限公司 | 2016-08-17 | — | — | CN | disclosed |
| CN-103284318-B | Sublingual cigarette and preparation method thereof | SHANDONG CO LTD OF CHINA NATIONALTOBACCO CORP | 2015-03-11 | — | — | CN | disclosed |
| CN-103284318-A | Sublingual cigarette and preparation method thereof | SHANDONG CO LTD OF CHINA NATIONALTOBACCO CORP | 2013-09-11 | — | — | CN | disclosed |
| CN-101454305-B | Flavonoid dimers and methods of making and using same | UNIV HONG KONG POLYTECHNIC | 2012-08-29 | — | — | CN | disclosed |
| WO-2012085864-A1 | ENCAPSULATES | PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) | 2012-06-28 | — | — | WO | disclosed |
| CN-1450394-B | Optical alignment method and liquid crystal display element | JSR CORP | 2010-04-28 | — | — | CN | disclosed |
| CN-1450394-A | Optical alignment method and liquid crystal display element | JSR CORP (JP) | 2003-10-22 | — | — | CN | disclosed |
| US-5106801-A | Hydrocracking catalysts, adsorbants | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1992-04-21 | — | — | US | disclosed |