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 | |
|---|---|---|---|---|
| SCHEMBL2095398 | 0.98 | — | — | |
| SCHEMBL6554645 | 0.70 | PDK1 (0.33) | — | |
| SCHEMBL1072148 | 0.68 | SIGMAR1 (0.44) | — | |
| SCHEMBL10815846 | 0.68 | SIGMAR1 (0.44) | — | |
| SCHEMBL3851995 | 0.65 | — | — | |
| SCHEMBL2093630 | 0.65 | — | — | |
| SCHEMBL5184879 | 0.64 | — | — | |
| SCHEMBL24693237 | 0.64 | — | — | |
| Water SCHEMBL1240345 | 0.64 | — | — | |
| SCHEMBL11238555 | 0.63 | GRM2 (0.48) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220195168-A1 | AQUEOUS RESIN COMPOSITION | TOYOBO CO., LTD. (JP) | 2022-06-23 | — | — | US | disclosed |
| EP-3954738-A1 | AQUEOUS RESIN COMPOSITION | TOYOBO CO., LTD. (JP) | 2022-02-16 | — | — | EP | disclosed |
| CN-113748167-A | Aqueous resin composition | 东洋纺株式会社 | 2021-12-03 | — | — | CN | disclosed |
| EP-1772488-B1 | PROCESS FOR PRODUCING AN AQUEOUS RESIN COMPOSITION | TOYO BOSEKI (JP) | 2017-09-06 | — | — | EP | disclosed |
| US-9290625-B2 | Aqueous resin composition and method of producing the same | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 2016-03-22 | — | — | US | disclosed |
| EP-1911805-B1 | AQUEOUS RESIN COMPOSITION AND METHOD FOR PRODUCING SAME | TOYO BOSEKI (JP) | 2012-04-18 | — | — | EP | disclosed |
| US-7737208-B2 | Water base resin composition, process for producing the same, paint, ink, adhesive, sealant and primer | TOYO KASEI KOGYO COMPANY LIMITED (JP) | 2010-06-15 | — | — | US | disclosed |
| US-20080287594-A1 | Water Base Resin Composition, Process for Producing the Same, Paint, Ink, Adhesive, Sealant and Primer | TOYO KASEI KOGYO COMPANY LIMITED (JP) | 2008-11-20 | — | — | US | disclosed |
| US-20080262137-A1 | Aqueous Resin Composition and Method of Producing the Same | TOYO KASEI KOGYO CO., LTD. (JP) | 2008-10-23 | — | — | US | disclosed |
| EP-1911805-A1 | AQUEOUS RESIN COMPOSITION AND METHOD FOR PRODUCING SAME | TOYO KASEI KOGYO COMPANY LIMITED (JP) | 2008-04-16 | — | — | EP | disclosed |
| EP-1772488-A1 | WATER BASE RESIN COMPOSITION, PROCESS FOR PRODUCING THE SAME, PAINT, INK, ADHESIVE, SEALANT AND PRIMER | TOYO KASEI KOGYO COMPANY LIMITED (JP) | 2007-04-11 | — | — | EP | disclosed |