Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. 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 | |
|---|---|---|---|---|
| Water SCHEMBL27579968 | 0.87 | — | — | |
| Water SCHEMBL28452689 | 0.87 | — | — | |
| Water SCHEMBL11756327 | 0.82 | — | — | |
| Water SCHEMBL16026709 | 0.82 | CA1 (0.33) | — | |
| Water SCHEMBL29521164 | 0.82 | — | — | |
| Water SCHEMBL9674547 | 0.82 | CA1 (0.33) | — | |
| Water SCHEMBL2492718 | 0.82 | — | — | |
| Water SCHEMBL11762477 | 0.82 | CA1 (0.33) | — | |
| Water SCHEMBL14343007 | 0.82 | CA1 (0.33) | — | |
| Water SCHEMBL11853728 | 0.82 | CA1 (0.33) | — |
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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113428897-B | Preparation method of vanadium-based cathode material based on surface modification for enhancing cycle stability | 湘潭大学 | 2022-10-28 | — | — | CN | claimed |
| CN-113788471-A | Viscosity reduction method of high-viscosity carbon nanotube conductive slurry | 福建格林韦尔材料科技有限公司 | 2021-12-14 | — | — | CN | claimed |
| CN-113428897-A | Preparation method of vanadium-based cathode material based on surface modification for enhancing cycle stability | 湘潭大学 | 2021-09-24 | — | — | CN | claimed |
| CN-114837014-B | Preparation method of clay compound for carbonless copy paper | 哈工大机器人集团(杭州湾)国际创新研究院 | 2022-12-13 | — | — | CN | disclosed |
| CN-113428897-B | Preparation method of vanadium-based cathode material based on surface modification for enhancing cycle stability | 湘潭大学 | 2022-10-28 | — | — | CN | disclosed |
| CN-114837014-A | Preparation method of clay compound for carbonless copy paper | 哈工大机器人集团(杭州湾)国际创新研究院 | 2022-08-02 | — | — | CN | disclosed |
| CN-114291855-A | Preparation method of full-concentration-gradient cathode material precursor, full-concentration-gradient cathode material and preparation method thereof | 万华化学(四川)有限公司 | 2022-04-08 | — | — | CN | disclosed |
| CN-114053394-A | Application of novel compound in preparation of medicine for preventing and/or treating coronavirus infection | 广州朗圣药业有限公司 | 2022-02-18 | — | — | CN | disclosed |
| CN-113788471-A | Viscosity reduction method of high-viscosity carbon nanotube conductive slurry | 福建格林韦尔材料科技有限公司 | 2021-12-14 | — | — | CN | disclosed |
| CN-113428897-A | Preparation method of vanadium-based cathode material based on surface modification for enhancing cycle stability | 湘潭大学 | 2021-09-24 | — | — | CN | disclosed |
| CN-107567666-B | Anode active material and secondary battery including the same | 汉阳大学校产学协力团 | 2021-02-02 | — | — | CN | disclosed |
| US-20040058936-A1 | Substituted piperidines/piperazines as melanocortin receptor agonists | ELI LILLY AND COMPANY | 2004-03-25 | — | — | US | disclosed |
| EP-1370558-A1 | PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2003-12-17 | — | — | EP | disclosed |
| EP-1368339-A1 | SUBSTITUTED PIPERIDINES/PIPERAZINES AS MELANOCORTIN RECEPTOR AGONISTS | Eli Lilly & Company (US) | 2003-12-10 | — | — | EP | disclosed |
| EP-1368340-A1 | PIPERAZINE DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2003-12-10 | — | — | EP | disclosed |
| EP-1358163-A1 | MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2003-11-05 | — | — | EP | disclosed |
| WO-2002059095-A1 | MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2002-08-01 | — | — | WO | disclosed |
| WO-2002059107-A1 | SUBSTITUTED PIPERIDINES/PIPERAZINES AS MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2002-08-01 | — | — | WO | disclosed |
| WO-2002059117-A1 | PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2002-08-01 | — | — | WO | disclosed |
| WO-2002059108-A1 | MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2002-08-01 | — | — | WO | disclosed |