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 SCHEMBL4363042 | 1.00 | — | — | |
| Water SCHEMBL7919166 | 1.00 | — | — | |
| Water SCHEMBL27729588 | 1.00 | — | — | |
| Water SCHEMBL27834608 | 0.93 | — | — | |
| Water SCHEMBL27787643 | 0.93 | — | — | |
| Water SCHEMBL27814888 | 0.93 | — | — | |
| Water SCHEMBL27809594 | 0.93 | — | — | |
| Water SCHEMBL29227064 | 0.93 | — | — | |
| Water SCHEMBL29038478 | 0.93 | — | — | |
| SCHEMBL6833743 | 0.91 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4142797-A1 | POLYETHYLENE GLYCOL-FUNCTIONALIZED TRIGLYCERIDE POLYOL POLYMERS | Kansas Soybean Commission (US) | 2023-03-08 | — | — | EP | claimed |
| CN-115768481-A | Polyethylene glycol functionalized triglyceride polyol polymers | 堪萨斯大豆委员会 | 2023-03-07 | — | — | CN | claimed |
| CN-113929885-B | Composite catalyst and application thereof in preparation of glycolide | 江苏金之虹新材料有限公司 | 2023-01-20 | — | — | CN | claimed |
| US-11298693-B2 | Method and catalyst for selective oligomerization of ethylene | PETROCHINA COMPANY LIMITED (CN) | 2022-04-12 | — | — | US | claimed |
| US-20210388160-A1 | POLYETHYLENE GLYCOL-FUNCTIONALIZED TRIGLYCERIDE POLYOL POLYMERS | KANSAS SOYBEAN COMMISSION | 2021-12-16 | — | — | US | claimed |
| WO-2021222006-A1 | POLYETHYLENE GLYCOL-FUNCTIONALIZED TRIGLYCERIDE POLYOL POLYMERS | KANSAS SOYBEAN COMMISSION (US) | 2021-11-04 | — | — | WO | claimed |
| US-4967031-A | NONCATALYTIC | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 1990-10-30 | — | — | US | claimed |
| EP-4142797-A1 | POLYETHYLENE GLYCOL-FUNCTIONALIZED TRIGLYCERIDE POLYOL POLYMERS | Kansas Soybean Commission (US) | 2023-03-08 | — | — | EP | disclosed |
| CN-115768481-A | Polyethylene glycol functionalized triglyceride polyol polymers | 堪萨斯大豆委员会 | 2023-03-07 | — | — | CN | disclosed |
| CN-113929885-B | Composite catalyst and application thereof in preparation of glycolide | 江苏金之虹新材料有限公司 | 2023-01-20 | — | — | CN | disclosed |
| US-11298693-B2 | Method and catalyst for selective oligomerization of ethylene | PETROCHINA COMPANY LIMITED (CN) | 2022-04-12 | — | — | US | disclosed |
| US-20210388160-A1 | POLYETHYLENE GLYCOL-FUNCTIONALIZED TRIGLYCERIDE POLYOL POLYMERS | KANSAS SOYBEAN COMMISSION | 2021-12-16 | — | — | US | disclosed |
| WO-2021222006-A1 | POLYETHYLENE GLYCOL-FUNCTIONALIZED TRIGLYCERIDE POLYOL POLYMERS | KANSAS SOYBEAN COMMISSION (US) | 2021-11-04 | — | — | WO | disclosed |
| US-5239079-A | Pyridinium salt and pharmacological composition containing the same | EISAI CO., LTD. (JP) | 1993-08-24 | — | — | US | disclosed |
| US-5162317-A | PYRIDINIUM SALT AND PHARMACOLOGICAL COMPOSITION CONTAINING THE SAME | ESAI CO., LTD. (JP) | 1992-11-10 | — | — | US | disclosed |
| EP-0374261-A1 | PYRIDINIUM SALT AND PHARMACOLOGICAL COMPOSITION CONTAINING THE SAME | Eisai Co., Ltd. (JP) | 1990-06-27 | — | — | EP | disclosed |
| WO-1989010927-A1 | PYRIDINIUM SALT AND PHARMACOLOGICAL COMPOSITION CONTAINING THE SAME | EISAI CO., LTD. (JP) | 1989-11-16 | — | — | WO | disclosed |