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 SCHEMBL9489446 | 1.00 | — | — | |
| Water SCHEMBL457728 | 1.00 | — | — | |
| Water SCHEMBL9136338 | 1.00 | — | — | |
| Water SCHEMBL8332252 | 1.00 | — | — | |
| Water SCHEMBL5193902 | 1.00 | — | — | |
| Water SCHEMBL486758 | 1.00 | — | — | |
| Water SCHEMBL5595444 | 1.00 | — | — | |
| Water SCHEMBL570871 | 1.00 | — | — | |
| Water SCHEMBL8664030 | 1.00 | — | — | |
| Water SCHEMBL10626151 | 1.00 | — | — |
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 453 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119371948-A | Thermosetting resin composition for well cementation and preparation method thereof | 中国石油天然气集团有限公司 | 2025-01-28 | — | — | CN | claimed |
| EP-3027164-B1 | FORMULATIONS AND MATERIALS WITH CATIONIC POLYMERS | UCL BUSINESS LTD (GB) | 2023-06-07 | — | — | EP | claimed |
| WO-2023080428-A1 | NANOPARTICLES FOR EARLY STRENGTH DEVELOPMENT OF CONCRETE, COMPOSITION FOR FORMING CONCRETE COMPRISING SAME, AND METHOD FOR PREPARING SAME | 주식회사 실크로드시앤티 | 2023-05-11 | — | — | WO | claimed |
| CN-112358736-B | Water-resistant salt-resistant thermosetting resin gel composition and preparation method thereof | 中国石油天然气集团有限公司 | 2023-03-21 | — | — | CN | claimed |
| CN-112429882-B | Method and device for treating ferrous fumarate wastewater | 南宁市泽威尔饲料有限责任公司 | 2023-01-20 | — | — | CN | claimed |
| CN-113707819-A | Preparation method of perovskite solar cell with copper indium oxide composite material as hole transport layer | 哈尔滨理工大学 | 2021-11-26 | — | — | CN | claimed |
| CN-112457829-A | Retarded thermosetting resin gelling composition and preparation method thereof | 中国石油天然气集团有限公司 | 2021-03-09 | — | — | CN | claimed |
| WO-2021039892-A1 | MEDICAL CALCIUM CARBONATE COMPOSITION, RELATED MEDICAL COMPOSITIONS, AND PRODUCTION METHODS THEREFOR | 石川 邦夫 | 2021-03-04 | — | — | WO | claimed |
| EP-3784642-A1 | TIME-RELEASE MOLYBDENUM FERTILIZER | Compass Minerals USA Inc. (US) | 2021-03-03 | — | — | EP | claimed |
| EP-3648731-B1 | ORAL CARE COMPOSITION | UNILEVER NV (NL) | 2021-02-17 | — | — | EP | claimed |
| WO-2004053229-A1 | FILLER-FIBER COMPOSITE | SPECIALTY MINERALS (MICHIGAN) INC. (US) | 2004-06-24 | — | — | WO | claimed |
| EP-0879049-B1 | PROCESS TO PREPARE SOLUBLE DELIVERY SYSTEMS USING VOLATILE SALTS | ELAN DRUG DELIVERY LTD (GB) | 2003-05-02 | — | — | EP | claimed |
| EP-1083901-B1 | EFAVIRENZ COMPRESSED TABLET FORMULATION | MERCK & CO INC (US) | 2003-04-16 | — | — | EP | claimed |
| EP-0854702-A1 | ANTIMICROBIAL COMPOSITIONS CONTAINING A C 3?-C 6? ALCOHOL | WARNER-LAMBERT COMPANY (US) | 1998-07-29 | — | — | EP | claimed |
| EP-0613858-B1 | Process for the preparation of dicalcium phosphate dihydrate suitable for an application in the toothpastes | HOECHST AG (DE) | 1997-05-14 | — | — | EP | claimed |
| WO-1997013495-A1 | ANTIMICROBIAL COMPOSITIONS CONTAINING A C3-C6 ALCOHOL | WARNER-LAMBERT COMPANY (US) | 1997-04-17 | — | — | WO | claimed |
| US-5427994-A | Hydrating calcium oxide; crystallization of fine particles | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ENVIRONMENTAL PROTECTION AGENCY (US) | 1995-06-27 | — | — | US | claimed |
| EP-0402596-B1 | PROCESS AND INSTALLATION FOR THE PREPARATION OF CALCIUM HYDROGEN PHOSPHATE | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-06-09 | — | — | EP | claimed |
| US-4882309-A | Lignosulfonate-modified calcium hydroxide for SO2 control during furnace injection | UNITED STATES OF AMERICA ENVIRONMENTAL PROTECTION AGENCY (US) | 1989-11-21 | — | — | US | claimed |
| EP-0271994-A1 | Lignosulfonate-modified calcium hydroxide for SO2 control during furnace injection | The United States Environmental Protection Agency (US) | 1988-06-22 | — | — | EP | claimed |