Isobutyramide

Isobutyramide

SCHEMBL2402176

CC(C)C(N)=O.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 Isobutyramide. 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
Isobutyramide SCHEMBL28256794 1.00 LMNA (0.43)
Isobutyramide SCHEMBL7090821 1.00
Isobutyramide SCHEMBL68431 1.00
Isobutyramide SCHEMBL27318890 0.96
Isobutyramide SCHEMBL27782244 0.96
Isobutyramide SCHEMBL27733619 0.96
Isobutyramide SCHEMBL2829019 0.96
Isobutyramide SCHEMBL11109750 0.96 LMNA (0.46)
Isobutyramide SCHEMBL3323 0.96
Isobutyramide SCHEMBL5830040 0.92

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166140-B CDK8/19 inhibitors 拜奥卡德联合股份公司 2024-06-14 CN claimed
CN-117924718-B Modified sodium carboxymethyl cellulose and preparation method thereof 恒达亲水胶体泰州有限公司 2024-06-04 CN claimed
CN-117187137-B Screening and preparation method for sewage treatment microbial inoculum 南通苏润环保科技有限公司 2024-05-28 CN claimed
CN-115677925-B Constant-rheological stabilizer, drilling fluid and preparation method thereof 中国石油天然气集团有限公司 2024-04-30 CN claimed
CN-117924718-A Modified sodium carboxymethyl cellulose and preparation method thereof 恒达亲水胶体泰州有限公司 2024-04-26 CN claimed
CN-117899934-A Chlorine-containing mildew amine organic porous polymer catalyst and synthetic method and application thereof 上海理工大学 2024-04-19 CN claimed
CN-116554396-B Polyacrylonitrile nanosphere modified polyacrylamide-acrylic acid gel electrolyte, preparation method and application thereof 中国海洋大学 2024-04-19 CN claimed
CN-117903534-A Synthesis method of double-tracing polystyrene nano-spheres 四川农业大学 2024-04-19 CN claimed
CN-117362518-A Ultra-deep water gas hydrate kinetic inhibitor and preparation method and application thereof 中海油海南能源有限公司 2024-01-09 CN claimed
CN-117219442-A Conductive polypyrrole nano microsphere and conductive hydrogel electrode material thereof 南京林业大学 2023-12-12 CN claimed
CN-105859679-A Compound and polymer prepared by using same 财团法人工业技术研究院 2016-08-17 CN claimed
CN-105297538-A High molecular reinforcing agent for paper, as well as preparation method and application of reinforcing agent UNIV JIANGNAN 2016-02-03 CN claimed
CN-105294931-A High molecular coagulant, as well as preparation method and application thereof UNIV JIANGNAN 2016-02-03 CN claimed
CN-104327219-A Aqueous emulsion for basic binder of adhesive for hard-bonding materials and preparation method thereof WUHAN JIEFENG JOINT ADHESIVE TECHNOLOGY CO LTD 2015-02-04 CN claimed
CN-104178064-A Composite pure waterborne hard-to-be-adhered material adhesive for packaging paper commodities and preparation method thereof WUHAN JIEFENG JOINT ADHESIVE TECHNOLOGY CO LTD 2014-12-03 CN claimed
CN-102269702-A Detection kit for determining small berry ORAC (oxygen radical absorbance capacity) and detection method thereof 2011-12-07 CN claimed
CN-101300708-B Improved membrane-electrode assemblies and long-life fuel cells BASF FUEL CELL GMBH 2010-12-29 CN claimed
US-7754077-B1 Dialysis membrane for separation on microchips SANDIA CORPORATION (US) 2010-07-13 US claimed
CN-101405304-A Method for producing polymers in aqueous solvents BASF SE (DE) 2009-04-08 CN claimed
CN-101300708-A Improved membrane-electrode assemblies and long-life fuel cells BASF FUEL CELL GMBH (DE) 2008-11-05 CN claimed