Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Acetic Acid Methyl Ester. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| Acetic Acid Methyl Ester SCHEMBL28103330 | 1.00 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28413948 | 0.96 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL7122055 | 0.96 | ALDH1A1 (0.91) | — | |
| Acetic Acid Methyl Ester SCHEMBL2414220 | 0.96 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL4479252 | 0.96 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL9688974 | 0.92 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28738052 | 0.92 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL2047402 | 0.92 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28113319 | 0.92 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL11147447 | 0.92 | ALDH1A1 (0.83) | — |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111234216-B | Zinc metalloporphyrin copolyimide and application thereof as photoelectric information storage material | 北京化工大学常州先进材料研究院 | 2022-09-13 | — | — | CN | claimed |
| CN-114247425-A | Preparation method and application of carbon nanorod spherical superstructure material | 南京大学 | 2022-03-29 | — | — | CN | claimed |
| CN-111234216-A | Zinc metalloporphyrin copolyimide and application thereof as photoelectric information storage material | 北京化工大学常州先进材料研究院 | 2020-06-05 | — | — | CN | claimed |
| CN-110176541-A | A kind of vulcanized lead Colloidal Quantum Dots solar battery and preparation method based on convection current assembling sedimentation | 苏州大学 | 2019-08-27 | — | — | CN | claimed |
| CN-115843187-B | Composite electron transport layer and preparation method thereof, and solar cell and preparation method thereof | 杭纳半导体装备(杭州)有限公司 | 2023-10-03 | — | — | CN | disclosed |
| CN-116666471-A | Copper zinc tin sulfur selenium solar cell and preparation method thereof | 中国科学院物理研究所 | 2023-08-29 | — | — | CN | disclosed |
| CN-114369591-B | Preparation method and application of composite immobilized enzyme material | 万华化学集团股份有限公司 | 2023-05-30 | — | — | CN | disclosed |
| CN-115843187-A | Composite electron transport layer and preparation method thereof, and solar cell and preparation method thereof | 杭纳半导体装备(杭州)有限公司 | 2023-03-24 | — | — | CN | disclosed |
| CN-115744807-A | Preparation method of flexible pressure sensor based on bionic hierarchical microstructure | 郑州大学 | 2023-03-07 | — | — | CN | disclosed |
| CN-114534518-B | Fullerene modified MOFs film and application thereof in helium gas separation | 清华大学 | 2023-01-24 | — | — | CN | disclosed |
| CN-111234216-B | Zinc metalloporphyrin copolyimide and application thereof as photoelectric information storage material | 北京化工大学常州先进材料研究院 | 2022-09-13 | — | — | CN | disclosed |
| CN-114534518-A | Fullerene modified MOFs film and application thereof in helium gas separation | 清华大学 | 2022-05-27 | — | — | CN | disclosed |
| CN-114247425-A | Preparation method and application of carbon nanorod spherical superstructure material | 南京大学 | 2022-03-29 | — | — | CN | disclosed |
| CN-111234216-A | Zinc metalloporphyrin copolyimide and application thereof as photoelectric information storage material | 北京化工大学常州先进材料研究院 | 2020-06-05 | — | — | CN | disclosed |
| CN-107233878-B | Preparation method of superfine zinc oxide nanoparticle/titanium dioxide nanowire composite photocatalytic material | 南昌航空大学 | 2020-02-07 | — | — | CN | disclosed |
| CN-110176541-A | A kind of vulcanized lead Colloidal Quantum Dots solar battery and preparation method based on convection current assembling sedimentation | 苏州大学 | 2019-08-27 | — | — | CN | disclosed |
| CN-106531892-B | A kind of organo-mineral complexing electroluminescent device and preparation method thereof | 天津职业技术师范大学 | 2018-06-08 | — | — | CN | disclosed |
| CN-105336500-A | Normal position modification processing method of thin film of ZnO nano-rod and obtained modified thin film thereof | JINGDEZHEN CERAMIC INST | 2016-02-17 | — | — | CN | disclosed |
| CN-105268423-A | ZnO quantum dot-MMT composite photocatalytic material and preparation method | UNIV SHAANXI SCIENCE & TECH | 2016-01-27 | — | — | CN | disclosed |
| CN-105244168-A | Preparation method of ZnO nano sheet thin film with multi-stage structure and thin film prepared by method | JINGDEZHEN CERAMIC INST | 2016-01-13 | — | — | CN | disclosed |