Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
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.
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 | |
|---|---|---|---|---|
| Butane SCHEMBL19031462 | 1.00 | — | — | |
| Butane SCHEMBL7201206 | 1.00 | TSHR (0.44) | — | |
| Butane SCHEMBL28166696 | 1.00 | — | — | |
| Butane SCHEMBL214592 | 1.00 | — | — | |
| Butane SCHEMBL11576752 | 0.93 | — | — | |
| Butane SCHEMBL3685383 | 0.93 | — | — | |
| Butane SCHEMBL11217023 | 0.93 | — | — | |
| Butane SCHEMBL4464144 | 0.93 | — | — | |
| Butane SCHEMBL11817602 | 0.93 | — | — | |
| Butane SCHEMBL30921500 | 0.93 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11007256-B2 | Synthetic lipopeptide vaccines and immunotherapeutics | THE UNIVERSITY OF TOLEDO (US) | 2021-05-18 | — | — | US | disclosed |
| US-20190231860-A1 | SYNTHETIC LIPOPEPTIDE VACCINES AND IMMUNOTHERAPEUTICS | THE UNIVERSITY OF TOLEDO (US) | 2019-08-01 | — | — | US | disclosed |
| US-10206988-B2 | Xenoantigen-displaying anti-cancer vaccines and method of making | THE UNIVERSITY OF TOLEDO (US) | 2019-02-19 | — | — | US | disclosed |
| WO-2018058086-A1 | SYNTHETIC LIPOPEPTIDE VACCINES AND IMMUNOTHERAPEUTICS | THE UNIVERSITY OF TOLEDO (US) | 2018-03-29 | — | — | WO | disclosed |
| US-20170072037-A1 | Xenoantigen-Displaying Anti-Cancer Vaccines and Method of Making | THE UNIVERSITY OF TOLEDO (US) | 2017-03-16 | — | — | US | disclosed |
| CN-103260848-B | For extruding the method for particle | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2016-05-11 | — | — | CN | disclosed |
| CN-103269843-B | For extruding mould and the method for particle | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2016-03-16 | — | — | CN | disclosed |
| EP-2852413-A1 | XENOANTIGEN-DISPLAYING ANTI-CANCER VACCINES AND METHOD OF MAKING | The University of Toledo (US) | 2015-04-01 | — | — | EP | disclosed |
| US-20150024037-A1 | Xenoantigen-Displaying Anti-Cancer Vaccines and Method of Making | THE UNIVERSITY OF TOLEDO (US) | 2015-01-22 | — | — | US | disclosed |
| CN-103269843-A | A die and a method for extruding particles | SHELL INT RESEARCH | 2013-08-28 | — | — | CN | disclosed |
| WO-2013123282-A1 | XENOANTIGEN-DISPLAYING ANTI-CANCER VACCINES AND METHOD OF MAKING | THE UNIVERSITY OF TOLEDO (US) | 2013-08-22 | — | — | WO | disclosed |
| CN-103260848-A | A process for extruding particles | SHELL INTERNAT RES | 2013-08-21 | — | — | CN | disclosed |
| CN-101454303-B | 3-ethyl oxetane compound with hydroxyl and preparation method thereof | UBE INDUSTRIES | 2012-07-04 | — | — | CN | disclosed |
| CN-101466767-B | resin composition for stereolithography | CMET INC. (JP) | 2011-12-07 | — | — | CN | disclosed |
| CN-101466767-A | Resin composition for stereolithography | CMET INC (JP) | 2009-06-24 | — | — | CN | disclosed |
| CN-101454303-A | 3-ethyl oxetane compound with hydroxyl and preparation method thereof | UBE INDUSTRIES (JP) | 2009-06-10 | — | — | CN | disclosed |
| US-4136065-A | LIQUID DIMETHYL ETHER AND WATER | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1979-01-23 | — | — | US | disclosed |
| US-4069351-A | HYDROPHILIC AND LIPOPHILIC FLAVOR AND ODOR COMPONENTS | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) | 1978-01-17 | — | — | US | disclosed |