Propane

Propane

SCHEMBL991503

CCC.CCC.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 Propane. 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
Propane SCHEMBL11515568 1.00
Propane SCHEMBL21358775 1.00 TSHR (0.38)
Propane SCHEMBL28491435 1.00
Propane SCHEMBL5383086 1.00
Propane SCHEMBL476510 1.00
Propane SCHEMBL28494483 1.00
Propane SCHEMBL460414 1.00
Propane SCHEMBL23703938 0.91
Propane SCHEMBL11599151 0.91
Propane SCHEMBL1248581 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115581817-A Biomedical coating material with antibacterial and lubricating functions and preparation method thereof 南京神奇科技开发有限公司 2023-01-10 CN claimed
CN-114716466-A Method for preparing chiral alpha-amino boric acid/boric acid ester through nickel-catalyzed asymmetric hydroamidation 南京大学 2022-07-08 CN claimed
CN-114316350-A Organosilicon quaternary ammonium salt blood-sucking sponge with antibacterial function and preparation method thereof 南京神奇科技开发有限公司 2022-04-12 CN claimed
CN-112010656-A Hafnium oxide fiber, preparation method thereof and application thereof in oxidation-resistant coating 华中科技大学 2020-12-01 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-20080000496-A1 Method of recycling crystal sensor of evaporation apparatus LG.PHILIPS LCD CO., LTD. (KR) 2008-01-03 US claimed
CN-1438278-A Dye composition containing diamino-pyrazole type oxidation substrate and coupling agent OREAL (FR) 2003-08-27 CN claimed
CN-1065126-C Hair styling conditioners PROCTER & GAMBLE (US) 2001-05-02 CN claimed
EP-0733689-B1 Chloroprene rubber adhesive composition KONISHI CO LTD (JP) 1998-10-07 EP claimed
US-5753727-A Chloroprene rubber adhesive with chlorinated polyolefin and epoxy resin KONISHI CO., LTD. (JP) 1998-05-19 US claimed
EP-0733689-A1 Chloroprene rubber adhesive composition KONISHI CO., LTD. (JP) 1996-09-25 EP claimed
CN-1056053-A HAIR STYLING CONDITIONERS PROCTER & GAMBLE (US) 1991-11-13 CN claimed
CN-115581817-A Biomedical coating material with antibacterial and lubricating functions and preparation method thereof 南京神奇科技开发有限公司 2023-01-10 CN disclosed
CN-114316350-A Organosilicon quaternary ammonium salt blood-sucking sponge with antibacterial function and preparation method thereof 南京神奇科技开发有限公司 2022-04-12 CN disclosed
CN-1056416-A HAIR STYLING SHAMPOOS PROCTER & GAMBLE (US) 1991-11-27 CN disclosed
CN-1049969-A The vehicle system that is used for cosmetic composition PROCTER & GAMBLE (US) 1991-03-20 CN disclosed
US-3956510-A NESTING, CYLINDERS, LOOPS BEALL NELSON J 1976-05-11 US disclosed