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 SCHEMBL30921500 | 1.00 | — | — | |
| Butane SCHEMBL5859491 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL11513745 | 0.93 | — | — | |
| Butane SCHEMBL7201206 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL19031462 | 0.93 | — | — | |
| Butane SCHEMBL28166696 | 0.93 | — | — | |
| Butane SCHEMBL30942544 | 0.93 | — | — | |
| Butane SCHEMBL214592 | 0.93 | — | — | |
| Butane SCHEMBL421381 | 0.93 | — | — | |
| Butane SCHEMBL22491 | 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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119113821-A | Preparation method of multi-channel chabazite molecular sieve membrane | 南京工业大学 | 2024-12-13 | — | — | CN | claimed |
| CN-110139829-A | Polyaluminium salt, use thereof in the preparation of high purity colloidal aluminium-silica composite particles and zeolite | 埃科莱布美国股份有限公司 | 2019-08-16 | — | — | CN | claimed |
| CN-105984879-B | A kind of MWW structure molecular screen and preparation method thereof | 中国石油化工股份有限公司 | 2019-05-21 | — | — | CN | claimed |
| CN-105983437-A | Catalyst containing MWW-structured molecular sieve as well as preparation method and application of catalyst | 中国石油化工股份有限公司 | 2016-10-05 | — | — | CN | claimed |
| CN-104024394-A | method and composition for removing material from a substrate | DYNALOY LLC | 2014-09-03 | — | — | CN | claimed |
| US-4266087-A | Process for preparing a myrcenol, cis-ocimenol mixture substantially free of trans-ocimenol | GIVAUDAN CORPORATION (US) | 1981-05-05 | — | — | US | claimed |
| CN-115925437-B | Integral honeycomb molecular sieve for VOCs removal and preparation and application thereof | 上海绿强新材料有限公司 | 2023-12-19 | — | — | CN | disclosed |
| CN-110471262-A | A kind of colored filter developer composition | HUAPU MICROELECTRONIC TECH NINGBO CO LTD | 2019-11-19 | — | — | CN | disclosed |
| CN-110139829-A | Polyaluminium salt, use thereof in the preparation of high purity colloidal aluminium-silica composite particles and zeolite | 埃科莱布美国股份有限公司 | 2019-08-16 | — | — | CN | disclosed |
| EP-3522937-A1 | CONTRAST MIXTURE AND USE THEREOF | Univerzita Pavla Jozefa Safárika V Kosiciach (SK) | 2019-08-14 | — | — | EP | disclosed |
| CN-105984879-B | A kind of MWW structure molecular screen and preparation method thereof | 中国石油化工股份有限公司 | 2019-05-21 | — | — | CN | disclosed |
| CN-105983437-B | A kind of catalyst of the structure molecular screen containing MWW, preparation method and applications | 中国石油化工股份有限公司 | 2019-02-01 | — | — | CN | disclosed |
| CN-105986308-B | Electrolyte composition for removing flash and method for removing flash | 化研科技株式会社 | 2018-04-13 | — | — | CN | disclosed |
| CN-101830811-A | Preparation method of 4-aminodiphenylamine | JIANGSU YANGNONG CHEMICAL GROUP CO LTD | 2010-09-15 | — | — | CN | disclosed |
| CN-101717339-A | Double quaternary ammonium base compound and preparation method as well as application thereof | JIANGSU YANGNONG CHEMICAL GROU | 2010-06-02 | — | — | CN | disclosed |
| CN-1297259-A | Fuel cell | BASF AG (DE) | 2001-05-30 | — | — | CN | disclosed |
| EP-0048725-A4 | EXTREME LOW MODULUS RTV COMPOSITIONS. | GEN ELECTRIC (US) | 1982-07-19 | — | — | EP | disclosed |
| EP-0048725-A1 | EXTREME LOW MODULUS RTV COMPOSITIONS | GENERAL ELECTRIC COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |
| US-4323489-A | ACETAMIDOSILANE COUPLER, AMINOXYSILANE OR KETOXIMOSILANE CURING AGENT | GENERAL ELECTRIC COMPANY (US) | 1982-04-06 | — | — | US | disclosed |
| WO-1981002895-A1 | EXTREME LOW MODULUS RTV COMPOSITIONS | GEN ELECTRIC (US) | 1981-10-15 | — | — | WO | disclosed |