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 SCHEMBL28172776 | 1.00 | DNM1 (0.89) | — | |
| Water SCHEMBL31147094 | 1.00 | DNM1 (0.89) | — | |
| Water SCHEMBL27506242 | 1.00 | DNM1 (0.89) | — | |
| Water SCHEMBL27567442 | 1.00 | DNM1 (0.89) | — | |
| Water SCHEMBL1726469 | 1.00 | DNM1 (0.89) | — | |
| Water SCHEMBL27524665 | 0.95 | DNM1 (0.80) | — | |
| Water SCHEMBL15710762 | 0.95 | DNM1 (0.80) | — | |
| Hydrochloric Acid SCHEMBL28962554 | 0.95 | DNM1 (0.80) | — | |
| SCHEMBL25262966 | 0.94 | DNM1 (1.00) | — | |
| SCHEMBL22684930 | 0.94 | DNM1 (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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117511490-A | Tannin-based polyurethane-urea adhesive and preparation method thereof | 西南林业大学 | 2024-02-06 | — | — | CN | claimed |
| CN-117000163-A | Nylon 66 production device and production method | 广东融塑新材料有限公司 | 2023-11-07 | — | — | CN | claimed |
| CN-116063726-B | Cellulose porous gel microsphere with uniform particle size, preparation method and application | 杭州纽龙生物科技有限公司 | 2023-09-19 | — | — | CN | claimed |
| CN-116688963-A | Endotoxin affinity chromatographic packing, preparation method, chromatographic column and filtering equipment | 无锡加莱克色谱科技有限公司 | 2023-09-05 | — | — | CN | claimed |
| CN-116162238-A | In-situ polymerization preparation method of spinning-grade conductive carbon nanotube nylon composite material | 广州明晖新材料有限公司 | 2023-05-26 | — | — | CN | claimed |
| CN-103502200-B | For the production of the technique of the improvement of hexamethylene-diamine | RADICI CHIMICA S.P.A. (IT) | 2016-01-20 | — | — | CN | claimed |
| EP-2697189-B1 | IMPROVED PROCESS FOR THE PRODUCTION OF HEXAMETHYLENEDIAMINE | RADICI CHIMICA SPA (IT) | 2015-07-01 | — | — | EP | claimed |
| US-8933272-B2 | Process for the production of hexamethlenediamine | RADICI CHIMICA S.P.A. (IT) | 2015-01-13 | — | — | US | claimed |
| US-20140024859-A1 | PROCESS FOR THE PRODUCTION OF HEXAMETHLENEDIAMINE | RADICI CHIMICA S.P.A. (IT) | 2014-01-23 | — | — | US | claimed |
| CN-103502200-A | An improved process for the production of hexamethylenediamine | RADICI CHIMICA S P A | 2014-01-08 | — | — | CN | claimed |
| CN-119897157-A | Isomerization catalyst, synthesis method and application thereof | 奥斯催化材料（大连)有限公司 | 2025-04-29 | — | — | CN | disclosed |
| CN-119750607-A | Nano rod-shaped ZSM-48 molecular sieve, preparation method thereof, hydroisomerization catalyst and application thereof | 国家能源集团宁夏煤业有限责任公司 | 2025-04-04 | — | — | CN | disclosed |
| CN-116040644-B | Molecular sieve and preparation method and application thereof | 中国石油化工股份有限公司 | 2025-04-04 | — | — | CN | disclosed |
| CN-116020572-B | Molecular sieve, preparation method thereof, hydroisomerization cracking catalyst and hydrocarbon oil hydroisomerization cracking treatment method | 中国石油化工股份有限公司 | 2025-03-14 | — | — | CN | disclosed |
| CN-116037200-B | Multi-stage hydroisomerization catalyst combination process and multi-stage hydroisomerization process | 中国石油化工股份有限公司 | 2025-03-11 | — | — | CN | disclosed |
| CN-1902132-A | High solids material processing | EXXONMOBIL RES & ENG CO (US) | 2007-01-24 | — | — | CN | disclosed |
| CN-1812933-A | Emm-3, new crystalline microporous material | EXXONMOBIL RES & ENG CO (US) | 2006-08-02 | — | — | CN | disclosed |
| CN-1720207-A | Aromatics conversion using ITQ-13 | EXXONMOBIL CHEM PATENTS INC (US) | 2006-01-11 | — | — | CN | disclosed |
| US-6784280-B1 | DOES NOT NECESSITATE A PH-ADJUSTING STEP (DOES NOT USE A SPECIAL PH-ADJUSTING AGENT) AND PERMITS THE REACTION OF A POLYSUCCINIMIDE (CO)POLYMER WITH A LEWIS BASE AT A TEMPERATURES WITHIN A WIDE RANGE | NIPPON SHOKUBAI CO., LTD. (JP) | 2004-08-31 | — | — | US | disclosed |
| EP-1120433-A1 | POLYSUCCINIMIDE (CO)POLYMER DERIVATIVE AND PROCESS FOR PRODUCING THE SAME | Nippon Shokubai Co., Ltd. (JP) | 2001-08-01 | — | — | EP | disclosed |