Butane

Butane

SCHEMBL9794485

CCCC.Cl.Cl.[Zr]

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 Butane. 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
Butane SCHEMBL465278 0.93
Butane SCHEMBL27927071 0.93 TSHR (0.44)
Butane SCHEMBL4362011 0.93 TSHR (0.44)
Butane SCHEMBL5851369 0.93
Butane SCHEMBL6912341 0.93
Butane SCHEMBL814744 0.93
Butane SCHEMBL18039280 0.93
Butane SCHEMBL28863388 0.93 TSHR (0.44)
Butane SCHEMBL12504128 0.86
Butane SCHEMBL11585619 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132641-A1 ULTRA-HIGH MOLECULAR WEIGHT POLYETHYLENE AND PREPARATION METHOD THEREFOR SINOPEC YANGZI PETROCHEMICAL LTD. (BV) 2024-04-25 US disclosed
EP-4286420-A1 ULTRA-HIGH MOLECULAR WEIGHT POLYETHYLENE AND PREPARATION METHOD THEREFOR China Petroleum & Chemical Corporation (CN) 2023-12-06 EP disclosed
WO-2022161399-A1 ULTRA-HIGH MOLECULAR WEIGHT POLYETHYLENE AND PREPARATION METHOD THEREFOR 中国石油化工股份有限公司 2022-08-04 WO disclosed
CN-103304705-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2016-01-27 CN disclosed
CN-103304701-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2016-01-27 CN disclosed
CN-103304708-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2016-01-27 CN disclosed
CN-103304695-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2016-01-20 CN disclosed
CN-103304702-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2016-01-20 CN disclosed
CN-103304704-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2015-12-16 CN disclosed
CN-103304706-B Load type non-metallocene catalyst, its preparation method and application thereof SINOPEC CORP. (CN) 2015-12-16 CN disclosed
CN-102039191-A Load type non-metallocene catalyst, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2011-05-04 CN disclosed
CN-102039188-A Supported non-metallocene catalyst, its preparation method and uses CHINA PETROLEUM & CHEMICAL 2011-05-04 CN disclosed
CN-102039187-A Load type non-metallocene catalyst as well as preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2011-05-04 CN disclosed
CN-101412766-A Magnesium compound load type non-metallocene catalyst and preparation thereof SINOPEC YANGZI PETROCHEMICAL (CN) 2009-04-22 CN disclosed
CN-101412765-A Load type catalyst, load type non-metallocene catalyst and preparations thereof SINOPEC YANGZI PETROCHEMICAL (CN) 2009-04-22 CN disclosed
CN-101412769-A Load type non-metallocene catalyst and preparation thereof SINOPEC YANGZI PETROCHEMICAL (CN) 2009-04-22 CN disclosed
CN-101412764-A Load type non-metallocene catalyst and preparation thereof SINOPEC YANGZI PETROCHEMICAL (CN) 2009-04-22 CN disclosed
CN-101412768-A Magnesium compound load type non-metallocene catalyst and preparation thereof SINOPEC YANGZI PETROCHEMICAL (CN) 2009-04-22 CN disclosed
CN-101412767-A Load type non-metallocene catalyst and preparation thereof SINOPEC YANGZI PETROCHEMICAL (CN) 2009-04-22 CN disclosed
US-5075090-A Atomizing, ignition, combustion of organometallic and/or organosilicon compounds in combustible organic liquid VISTA CHEMICAL COMPANY (US) 1991-12-24 US disclosed