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 SCHEMBL17629249 | 1.00 | — | — | |
| Water SCHEMBL1465626 | 1.00 | — | — | |
| Water SCHEMBL30488446 | 1.00 | — | — | |
| Water SCHEMBL7995199 | 1.00 | — | — | |
| Water SCHEMBL7246743 | 1.00 | — | — | |
| Water SCHEMBL17629250 | 1.00 | — | — | |
| Water SCHEMBL22322406 | 0.91 | — | — | |
| Water SCHEMBL17199831 | 0.91 | — | — | |
| Water SCHEMBL22581632 | 0.91 | — | — | |
| Water SCHEMBL20742992 | 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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4504827-B1 | VALUE CHAIN RETURN PROCESS FOR THE RECOVERY OF PHOSPHOROUS ESTER-BASED FLAME RETARDANTS FROM POLYURETHANE RIGID FOAMS | BASF SE (DE) | 2026-05-06 | — | — | EP | disclosed |
| EP-3921298-B1 | PROCESS FOR THE PRODUCTION OF ACETALS FROM CARBON DIOXIDE | BASF SE (DE) | 2025-12-03 | — | — | EP | disclosed |
| EP-4504827-A1 | VALUE CHAIN RETURN PROCESS FOR THE RECOVERY OF PHOSPHOROUS ESTER-BASED FLAME RETARDANTS FROM POLYURETHANE RIGID FOAMS | BASF SE (DE) | 2025-02-12 | — | — | EP | disclosed |
| US-12012426-B2 | Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2024-06-18 | — | — | US | disclosed |
| EP-4136065-B1 | HYDROGENATION OF L-SORBOSE | BASF SE (DE) | 2024-04-24 | — | — | EP | disclosed |
| WO-2023194140-A1 | VALUE CHAIN RETURN PROCESS FOR THE RECOVERY OF PHOSPHOROUS ESTER-BASED FLAME RETARDANTS FROM POLYURETHANE RIGID FOAMS | BASF SE (DE) | 2023-10-12 | — | — | WO | disclosed |
| EP-4229123-A1 | VALUE CHAIN RETURN PROCESS FOR SPENT POLYAMIDES BY HYDROGENATION | BASF SE (DE) | 2023-08-23 | — | — | EP | disclosed |
| EP-4229110-A1 | VALUE CHAIN RETURN PROCESS FOR SPENT POLYURETHANES BY HYDROGENATION | BASF SE (DE) | 2023-08-23 | — | — | EP | disclosed |
| US-20230219983-A1 | TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2023-07-13 | — | — | US | disclosed |
| CN-116419949-A | Value chain regression process for scrap polyamides by hydrogenation | 巴斯夫欧洲公司 | 2023-07-11 | — | — | CN | disclosed |
| EP-1704057-A1 | LASER IMAGING | Sherwood Technology LTD. (GB) | 2006-09-27 | — | — | EP | disclosed |
| EP-1644329-A1 | HYDROGEN PEROXIDE CATALYZED PROCESS FOR THE PREPARATION OF STERICALLY HINDERED N-HYDROCARBYLOXYAMINES | Ciba SC Holding AG (CH) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005068207-A1 | LASER IMAGING | DATALASE LTD. (GB) | 2005-07-28 | — | — | WO | disclosed |
| WO-2005005388-A1 | HYDROGEN PEROXIDE CATALYZED PROCESS FOR THE PREPARATION OF STERICALLY HINDERED N-HYDROCARBYLOXYAMINES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2005-01-20 | — | — | WO | disclosed |
| EP-1427759-A1 | TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION | Equistar Chemicals, LP (US) | 2004-06-16 | — | — | EP | disclosed |
| US-6693154-B2 | AN ORGANOMETALLIC COMPLEX CONTAINS A TRANSITION OR LANTHANIDE METAL AND 1,3-BIS(ARYLIMINO)ISOINDOLINE OR 1,3-BIS(HETEROARYLIMINO) ISOINDOLINE; ETHYLENE COPOLYMER WITH HIGH MOLECULAR WEIGHT, BROAD MOLECULAR WEIGHT DISTRIBUTION | EQUISTAR CHEMICALS, LP | 2004-02-17 | — | — | US | disclosed |
| US-20030065113-A1 | Transition metal catalysts for olefin polymerization | EQUISTAR CHEMICALS, LP | 2003-04-03 | — | — | US | disclosed |
| WO-2003022889-A1 | TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION | EQUISTAR CHEMICALS, LP (US) | 2003-03-20 | — | — | WO | disclosed |
| US-4346020-A | HOMOLOGATION OF METHANOL | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1982-08-24 | — | — | US | disclosed |
| EP-0055887-A2 | Novel catalyst system and process for producing ethanol using said novel catalyst system | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1982-07-14 | — | — | EP | disclosed |