Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Acetonitrile. 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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL15940238 | 1.00 | TSHR (0.33) | — | |
| Acetonitrile SCHEMBL9838754 | 1.00 | TSHR (0.33) | — | |
| Acetonitrile SCHEMBL19376785 | 1.00 | TSHR (0.33) | — | |
| Acetonitrile SCHEMBL288686 | 1.00 | — | — | |
| Acetonitrile SCHEMBL9935942 | 1.00 | TSHR (0.33) | — | |
| Acetonitrile SCHEMBL25284595 | 1.00 | TSHR (0.33) | — | |
| Acetonitrile SCHEMBL27867164 | 1.00 | — | — | |
| Acetonitrile SCHEMBL167513 | 1.00 | — | — | |
| Acetonitrile SCHEMBL1571600 | 1.00 | — | — | |
| Acetonitrile SCHEMBL2186630 | 0.94 | — | — |
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 228 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110208394-A | The detection method of Ractopamine, salbutamol and Clenbuterol in a kind of poultry meat | 上海康识食品科技有限公司 | 2019-09-06 | — | — | CN | claimed |
| CN-110057946-A | A kind of method and preprocessing system of micrometric measurement family product middle-ultraviolet lamp absorbent | 广东产品质量监督检验研究院（国家质量技术监督局广州电气安全检验所、广东省试验认证研究院、华安实验室） | 2019-07-26 | — | — | CN | claimed |
| CN-106166480-B | Adsorbent material and its preparation method and application a kind of while that there is cation exchange and reverse phase reserve capability | 浙江省中医药研究院 | 2019-06-25 | — | — | CN | claimed |
| CN-107422062-B | Method that is a kind of while measuring Benzbromarone in health food, Allopurinol and probenecid content | 广东产品质量监督检验研究院 | 2019-06-25 | — | — | CN | claimed |
| CN-109870519-A | A kind of detection method characterizing sucrose doped level in tealeaves using sucrose and fructose conversion content | 中国农业科学院茶叶研究所 | 2019-06-11 | — | — | CN | claimed |
| CN-109828054-A | The method that GPC-LC-MS-MS method measures industrial dye in food | 浙江宏正检测有限公司 | 2019-05-31 | — | — | CN | claimed |
| CN-109738554-A | The method of micro phenylacetic acid in Solid Phase Extraction-liquid chromatogram combination measurement water | 河北诚信集团有限公司 | 2019-05-10 | — | — | CN | claimed |
| CN-109709255-A | The high performance liquid chromatography tandem mass spectrum detection method of free catecholamine and its metabolin in human urine | 杭州凯莱谱精准医疗检测技术有限公司 | 2019-05-03 | — | — | CN | claimed |
| CN-109134313-A | A method of Vorinostat is prepared using modified mesoporous material catalysis | 陈国妃 | 2019-01-04 | — | — | CN | claimed |
| CN-109096148-A | The method for preparing Vorinostat using modified mesoporous material one kettle way | 陈国妃 | 2018-12-28 | — | — | CN | claimed |
| CN-108620048-A | The amine-modified magnetic microsphere preparation method and application of polyethyleneimine | 天津大学 | 2018-10-09 | — | — | CN | claimed |
| CN-108519454-A | The remaining pre-treating method of Multiple Pesticides and its detection method in a kind of measurement tealeaves | 武夷学院 | 2018-09-11 | — | — | CN | claimed |
| CN-108398498-A | The quick quantitative analytic method of four kinds of bisphenol compounds in a kind of common food | 宁波市疾病预防控制中心 | 2018-08-14 | — | — | CN | claimed |
| CN-103197014-B | Method for measuring derivatization in valproic acid body fluid concentration process through high performance liquid chromatography | LIUZHOU CITY WOMEN AND CHILDREN HOSPITAL | 2014-11-12 | — | — | CN | claimed |
| CN-103197014-A | Method for measuring derivatization in valproic acid body fluid concentration process through high performance liquid chromatography | LIUZHOU CITY WOMEN AND CHILDREN HOSPITAL | 2013-07-10 | — | — | CN | claimed |
| CN-118359610-A | MENIN-MLL interaction inhibitors | 生命医药有限责任公司 | 2024-07-19 | — | — | CN | disclosed |
| CN-110291087-B | Tetrahydronaphthalene and tetrahydroisoquinoline derivatives as estrogen receptor degrading agents | 阿尔维纳斯运营股份有限公司 | 2024-07-09 | — | — | CN | disclosed |
| EP-0158775-A1 | Substituted sulfonamidobenzamides, antiarrythmic agents and compositions thereof | SCHERING AKTIENGESELLSCHAFT (DE) | 1985-10-23 | — | — | EP | disclosed |
| US-4544654-A | Substituted sulfonamidobenzamides, antiarrhythmic agents and compositions thereof | SCHERING A.G. (DE) | 1985-10-01 | — | — | US | disclosed |
| EP-0098951-A2 | Aminobenzamide derivatives and preparation thereof | STERLING DRUG INC. (US) | 1984-01-25 | — | — | EP | disclosed |