Ethane

Ethane

SCHEMBL547701

CC.CC.CC.Cl.Cl.Cl

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Ethane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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.

Compoundsimilaritytop predictedshared targets
Ethane SCHEMBL787221 1.00
Ethane SCHEMBL1535923 1.00
Ethane SCHEMBL5922742 1.00 CA4 (0.33)
Ethane SCHEMBL27501687 1.00
Ethane SCHEMBL5922746 1.00
Ethane SCHEMBL6266512 1.00
Ethane SCHEMBL1087781 1.00
Ethane SCHEMBL1535922 1.00 CA4 (0.33)
Ethane SCHEMBL547702 1.00
Ethane SCHEMBL395298 1.00

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 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111936456-A Improved process for the preparation of chlorinated alkenes by caustic dehydrochlorination of chlorinated alkanes in a jet loop reactor 蓝立方知识产权有限责任公司 2020-11-13 CN claimed
US-9388150-B2 Method for preparing 5-acetoxymethylfurfural using alkylammonium acetate KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2016-07-12 US claimed
US-20150051413-A1 NOVEL METHOD FOR PREPARING 5-ACETOXYMETHYLFURFURAL USING ALKYLAMMONIUM ACETATE SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2015-02-19 US claimed
US-8889891-B2 Method for preparing a furfuranol-based compound and 2-furancarboxylic acid-based compound using an ionic liquid as a solvent KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2014-11-18 US claimed
US-20130345446-A1 METHOD FOR PREPARING A FURFURANOL-BASED COMPOUND AND 2-FURANCARBOXYLIC ACID-BASED COMPOUND USING AN IONIC LIQUID AS A SOLVENT SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2013-12-26 US claimed
US-20120136189-A1 BUFFERED IONIC LIQUIDS FOR OLEFIN DIMERIZATION CONOCOPHILLIPS COMPANY - IP SERVICES GROUP (US) 2012-05-31 US claimed
WO-2010132059-A1 NON-FLAMMABLE WATERPROOFING ROOFING COMPOSITION WALL-GUARD CORPORATION OF OHIO (US) 2010-11-18 WO claimed
US-7811636-B2 Non-flammable waterproofing composition ELASTIKOTE, LLC (US) 2010-10-12 US claimed
US-20100112227-A1 NON-FLAMMABLE WATERPROOFING COMPOSITION ELASTIKOTE, LLC (US) 2010-05-06 US claimed
US-7642312-B2 Non-flammable waterproofing composition ELASTIKOTE, LLC (US) 2010-01-05 US claimed
US-7598310-B2 Non-flammable waterproofing composition ELASTIKOTE, LLC (US) 2009-10-06 US claimed
US-20090242857-A1 NON-FLAMMABLE WATERPROOFING COMPOSITION WALL-GUARD CORPORATION OF OHIO (US) 2009-10-01 US claimed
US-20060281855-A1 NON-FLAMMABLE WATERPROOFING COMPOSITION WALL-GUARD CORPORATION OF OHIO (US) 2006-12-14 US claimed
US-7084201-B2 Non-flammable waterproofing composition WALL-GUARD CORPORATION OF OHIO (US) 2006-08-01 US claimed
US-20050107514-A1 Non-flammable waterproofing composition WALL-GUARD CORPORATION 2005-05-19 US claimed
US-3969205-A PHOTOLYTIC SEITETSU KAGAKU CO., LTD. (JA) 1976-07-13 US claimed
JP-57105229-A None JP disclosed
JP-2296136-A None JP disclosed
JP-S57105229-A TREATMENT OF WASTE GAS FOR OXYCHLORINATION REACTION TOAGOSEI CHEM IND CO LTD 1982-06-30 JP disclosed
US-3969205-A PHOTOLYTIC SEITETSU KAGAKU CO., LTD. (JA) 1976-07-13 US disclosed