Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Ethyl Acetate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.39 |
| ▸ | ACHE known ✓ | P22303 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| Hexane SCHEMBL28261498 | 0.98 | ALDH1A1 (0.58) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL27623309 | 0.98 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL2675053 | 0.98 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL27985868 | 0.96 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Hexane SCHEMBL28061489 | 0.96 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL28371765 | 0.96 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Hexane SCHEMBL5311101 | 0.96 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL2264348 | 0.96 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL11027649 | 0.96 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| Ethyl Acetate SCHEMBL29257732 | 0.96 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104829666-B | A kind of method that high-purity baicalin is prepared from radix scutellariae | 山西大学 | 2018-05-15 | — | — | CN | claimed |
| CN-104829666-A | Method for preparing high purity baicalin from radix scutellariae | UNIV SHANXI | 2015-08-12 | — | — | CN | claimed |
| CN-103772401-A | New refining method of 11-chloro-2,3,3a,12b-tetrahydro-2-methyl-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrryl-1-one | AVENTIS PHARMA HAINAN CO LTD | 2014-05-07 | — | — | CN | claimed |
| CN-101775028-B | Method for gathering and purifying agrimonine in agrimony | DAXINGANLING LINGONBERRY ORGANIC FOODSTUFFS CO LTD | 2013-08-14 | — | — | CN | claimed |
| CN-102060677-B | Method for enriching and purifying eugenol in Chinese pink herb | DAXINGANLING GADOL SPORTS INGREDIENT CO LTD | 2013-06-05 | — | — | CN | claimed |
| CN-102101893-A | Method for enriching and purifying aloe polysaccharides in aloe | DAXINGANLING LINGONBERRY ORGANIC FOODSTUFFS CO LTD | 2011-06-22 | — | — | CN | claimed |
| CN-102060677-A | Method for enriching and purifying eugenol in Chinese pink herb | DAXINGANLING GADOL SPORTS INGREDIENT CO LTD | 2011-05-18 | — | — | CN | claimed |
| CN-101775028-A | Method for enriching and purifying agrimonine in agrimony | DAXINGANLING LINGONBERRY ORGAN | 2010-07-14 | — | — | CN | claimed |
| CN-1365980-A | Process for preparing high-purity rhodioloside | TIANCHUN WEITONG BIO TECHNOLOG (CN) | 2002-08-28 | — | — | CN | claimed |
| CN-116445221-A | Sclareum oil and preparation method thereof | 湖北中烟工业有限责任公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-113295816-B | Thin layer chromatography detection method for Yihechun preparation | 苏中药业集团股份有限公司 | 2022-12-27 | — | — | CN | disclosed |
| CN-110845566-B | Dammarane triterpene glycoside compound and preparation method and application thereof | 广西壮族自治区中国科学院广西植物研究所 | 2021-09-28 | — | — | CN | disclosed |
| CN-113295816-A | Thin layer chromatography detection method for Yihechun preparation | 江苏苏中药业集团股份有限公司 | 2021-08-24 | — | — | CN | disclosed |
| CN-110845566-A | Dammarane triterpene glycoside compound and preparation method and application thereof | 广西壮族自治区中国科学院广西植物研究所 | 2020-02-28 | — | — | CN | disclosed |
| CN-102101893-A | Method for enriching and purifying aloe polysaccharides in aloe | DAXINGANLING LINGONBERRY ORGANIC FOODSTUFFS CO LTD | 2011-06-22 | — | — | CN | disclosed |
| CN-102060677-A | Method for enriching and purifying eugenol in Chinese pink herb | DAXINGANLING GADOL SPORTS INGREDIENT CO LTD | 2011-05-18 | — | — | CN | disclosed |
| CN-101775028-A | Method for enriching and purifying agrimonine in agrimony | DAXINGANLING LINGONBERRY ORGAN | 2010-07-14 | — | — | CN | disclosed |
| CN-100594034-C | Blood-sugar lowering A preparation for treating diabetes, its preparation method and quality-control method | TAIER PHARMACEUTICAL RES INST GUIZHOU | 2010-03-17 | — | — | CN | disclosed |
| CN-1903325-A | Blood-sugar lowering A prepn. for treating diabetes, its prepn. method and quality-control method | TAIER PHARMACEUTICAL RES INST (CN) | 2007-01-31 | — | — | CN | disclosed |
| CN-1365980-A | Process for preparing high-purity rhodioloside | TIANCHUN WEITONG BIO TECHNOLOG (CN) | 2002-08-28 | — | — | CN | disclosed |