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.
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 SCHEMBL27927071 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL4362011 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL465278 | 0.93 | — | — | |
| Butane SCHEMBL814744 | 0.93 | — | — | |
| Butane SCHEMBL5851369 | 0.93 | — | — | |
| Butane SCHEMBL28863388 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL30942544 | 0.93 | — | — | |
| Butane SCHEMBL18039280 | 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 381 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3455234-B1 | SECO MACROLIDE COMPOUNDS | SELVITA D O O (HR) | 2026-04-01 | — | — | EP | claimed |
| CN-119776078-A | Cleaning composition | 宝洁公司 | 2025-04-08 | — | — | CN | claimed |
| CN-119113821-A | Preparation method of multi-channel chabazite molecular sieve membrane | 南京工业大学 | 2024-12-13 | — | — | CN | claimed |
| US-20240328084-A1 | DELIGNIFICATION OF MATERIALS IN DEEP EUTECTIC SOLVENTS | TEXAS TECH UNIVERSITY SYSTEM (US) | 2024-10-03 | — | — | US | claimed |
| CN-117903865-A | Release agent composition for papermaking, release agent emulsion, and preparation method and application thereof | 埃科莱布美国股份有限公司 | 2024-04-19 | — | — | CN | claimed |
| WO-2024078554-A1 | A RELEASE AGENT COMPOSITION FOR PAPERMAKING, A RELEASE AGENT EMULSION AND PREPARATION METHOD AND APPLICATIONS THEREOF | ECOLAB USA INC. (US) | 2024-04-18 | — | — | WO | claimed |
| CN-117550569-A | Method for producing hypophosphorous acid by using organic amine | 云南云天化股份有限公司 | 2024-02-13 | — | — | CN | claimed |
| CN-116084168-A | Liquid fabric softener compositions comprising hydroxypropyl starch phosphate and methods of use thereof | 诺力昂化学品国际有限公司 | 2023-05-09 | — | — | CN | claimed |
| US-11512096-B2 | Seco macrolide compounds | SELVITA D.O.O. (HR) | 2022-11-29 | — | — | US | claimed |
| CN-114225894-B | Oxygen vacancy-rich aluminum oxide base heterojunction material and preparation method thereof | 河北科技大学 | 2022-11-29 | — | — | CN | claimed |
| US-6287545-B1 | MIXTURE OF A QUATERNARY COMPOUND, LOTION AND PROTECTIVE COLLOID | COLGATE-PALMOLIVE COMPANY | 2001-09-11 | — | — | US | claimed |
| EP-1109874-A1 | NOVEL COMPOSITION OF FERRIC CHLORIDE AND A DIALKYL DIALLYL AMMONIUM POLYMER AND PROCESS OF PREPARING THE SAME | Calgon Corporation (US) | 2001-06-27 | — | — | EP | claimed |
| EP-1079917-A1 | COMPLEXES OF ULTRAVIOLET ABSORBERS AND QUATERNARY AMMONIUM COMPOUNDS WHICH ARE SUBSTANTIALLY FREE FROM UNWANTED SALTS | MILLIKEN RESEARCH CORPORATION (US) | 2001-03-07 | — | — | EP | claimed |
| US-6184257-B1 | Composition of ferric chloride and a dialkyl diallyl ammonium polymer and process of preparing the same | CALGON CORPORATION | 2001-02-06 | — | — | US | claimed |
| WO-2000063316-A1 | NOVEL COMPOSITION OF FERRIC CHLORIDE AND A DIALKYL DIALLYL AMMONIUM POLYMER AND PROCESS OF PREPARING THE SAME | CALGON CORPORATION (US) | 2000-10-26 | — | — | WO | claimed |
| WO-1999055453-A1 | COMPLEXES OF ULTRAVIOLET ABSORBERS AND QUATERNARY AMMONIUM COMPOUNDS WHICH ARE SUBSTANTIALLY FREE FROM UNWANTED SALTS | MILLIKEN RESEARCH CORPORATION (US) | 1999-11-04 | — | — | WO | claimed |
| US-5035808-A | Synergistic mixture of ferric salt and cationic polymer such as a polyamine or diallyldialkylammonium halide; low turbidity waters | CALGON CORPORATION (US) | 1991-07-30 | — | — | US | claimed |
| EP-0366843-A1 | Flocculation of suspended solids from aqueous solutions | CALGON CORPORATION (US) | 1990-05-09 | — | — | EP | claimed |
| US-4746457-A | SYNERGISTIC MIXTURE OF ALUMINUM CHLORIDE AND CATIONIC POLYMER | CALGON CORPORATION (US) | 1988-05-24 | — | — | US | 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 |