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 SCHEMBL28350050 | 1.00 | APLNR (0.32) | — | |
| Acetonitrile SCHEMBL1832586 | 1.00 | — | — | |
| Acetonitrile SCHEMBL7316992 | 0.96 | — | — | |
| Acetonitrile SCHEMBL15092908 | 0.96 | APLNR (0.33) | — | |
| Acetonitrile SCHEMBL16267901 | 0.96 | APLNR (0.33) | — | |
| Acetonitrile SCHEMBL522737 | 0.96 | — | — | |
| Acetonitrile SCHEMBL9936942 | 0.96 | APLNR (0.33) | — | |
| Acetonitrile SCHEMBL16267560 | 0.96 | APLNR (0.33) | — | |
| Acetonitrile SCHEMBL28516249 | 0.96 | — | — | |
| Acetonitrile SCHEMBL15092655 | 0.96 | APLNR (0.33) | — |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101623477-A | Novel process for Chinese medicinal composition for reducing blood fat and method for preparing novel formulations | BEIJING TIANJIAO AOTEQI CHINES | 2010-01-13 | — | — | CN | claimed |
| CN-100522191-C | Fingerprint atlas detection method for tanshin polyphenolic acid salts | LUGU PHARMACEUTICAL CO LTD (CN) | 2009-08-05 | — | — | CN | claimed |
| CN-1911273-A | Fingerprint atlas detection method for powder injection contg. high content of tanshin polyphenolic acid salts | LUGU PHARMACEUTICAL CO LTD SHA (CN) | 2007-02-14 | — | — | CN | claimed |
| CN-1264014-C | Method for quantitatively measuring tanshinonic acid B in red sage root | XUHUI DISTR CENTRAL HOSPITAL S (CN) | 2006-07-12 | — | — | CN | claimed |
| CN-1435688-A | Method for quantitatively measuring tanshinonic acid B in red sage root | XUHUI DISTR CENTRAL HOSPITAL S (CN) | 2003-08-13 | — | — | CN | claimed |
| CN-117054209-B | Dilution of smoke nicotine and extraction and detection method | 宁波镇海质谱技术研究院 | 2024-07-12 | — | — | CN | disclosed |
| CN-117054209-A | Dilution of smoke nicotine and extraction and detection method | 宁波镇海质谱技术研究院 | 2023-11-14 | — | — | CN | disclosed |
| CN-115364077-B | Lonicera edulis lutein preparation, eye drop and application thereof in relieving eye fatigue | 陕西美芙康生物科技有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-114848606-B | Salvianolic acid B and powder fog agent capsule and preparation method thereof | 惠州市九惠制药股份有限公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-116626182-A | Azalea quality detection method based on chemical fingerprint spectrum and quality difference components | 贵州医科大学 | 2023-08-22 | — | — | CN | disclosed |
| CN-116077546-A | Lonicera edulis lutein preparation, eye drop and application thereof in relieving eye fatigue | 浙江双糖生物科技有限公司 | 2023-05-09 | — | — | CN | disclosed |
| CN-115364077-A | Lonicera edulis xanthophyll preparation, eye drops and application of eye drops in relieving asthenopia | 浙江双糖生物科技有限公司 | 2022-11-22 | — | — | CN | disclosed |
| CN-1264014-C | Method for quantitatively measuring tanshinonic acid B in red sage root | XUHUI DISTR CENTRAL HOSPITAL S (CN) | 2006-07-12 | — | — | CN | disclosed |
| CN-1264014-C | Method for quantitatively measuring tanshinonic acid B in red sage root | XUHUI DISTR CENTRAL HOSPITAL S (CN) | 2006-07-12 | — | — | CN | disclosed |
| CN-1220489-C | Freeze-dried Danhong powder injection for injection and its preparing method | QIANLUCHUN SCIENCE AND TECHNOL (CN) | 2005-09-28 | — | — | CN | disclosed |
| CN-1554335-A | Freeze-dried Danhong powder injection for injection and its preparing method | 北京乾露春科技有限公司 | 2004-12-15 | — | — | CN | disclosed |
| CN-1435688-A | Method for quantitatively measuring tanshinonic acid B in red sage root | XUHUI DISTR CENTRAL HOSPITAL S (CN) | 2003-08-13 | — | — | CN | disclosed |
| CN-1435688-A | Method for quantitatively measuring tanshinonic acid B in red sage root | XUHUI DISTR CENTRAL HOSPITAL S (CN) | 2003-08-13 | — | — | CN | disclosed |
| US-20010048918-A1 | FOOD PRODUCTS CONTAINING BACTERIA WITH CHOLESTEROL LOWERING ACTIVITY | THOMAS J. LIPTON, DIVISION OF CONOPCO, INC. | 2001-12-06 | — | — | US | disclosed |
| EP-0792586-A2 | Food products containing bacteria with cholesterol lowering activity | UNILEVER N.V. (NL) | 1997-09-03 | — | — | EP | disclosed |