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 | |
|---|---|---|---|---|
| SCHEMBL313343 | 0.98 | — | — | |
| SCHEMBL15074245 | 0.98 | — | — | |
| SCHEMBL14251172 | 0.98 | — | — | |
| Ammonia Solution, Strong SCHEMBL11240480 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL27837501 | 0.95 | — | — | |
| Methyl Alcohol SCHEMBL2743758 | 0.93 | KMT2A (0.40) | — | |
| Methylene Chloride SCHEMBL10495455 | 0.91 | POLB (0.38) | — | |
| SCHEMBL26985875 | 0.91 | — | — | |
| SCHEMBL1961398 | 0.91 | — | — | |
| Acetonitrile SCHEMBL29244248 | 0.90 | MAPT (0.36) | — |
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 147 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119350434-B | Process synthesis method for cleavable linker Ala-Ala-Ala | 苏州共康医药科技有限公司 | 2025-04-29 | — | — | CN | claimed |
| CN-119350434-A | Process synthesis method for cleavable linker Ala-Ala-Ala | 苏州共康医药科技有限公司 | 2025-01-24 | — | — | CN | claimed |
| CN-118290368-A | Method for separating tetrahydrofuran-ethanol-water-acetonitrile azeotropic system by extractive distillation | 天津仁爱学院 | 2024-07-05 | — | — | CN | claimed |
| CN-115181080-B | Separation process of methyl tertiary butyl ether-tetrahydrofuran-ethanol-water azeotropic system | 扬州贝尔新环境科技有限公司 | 2023-08-22 | — | — | CN | claimed |
| CN-115215853-A | Preparation method of compound serving as farnesoid X receptor agonist | 四川科伦博泰生物医药股份有限公司 | 2022-10-21 | — | — | CN | claimed |
| CN-115181080-A | Separation process of methyl tert-butyl ether-tetrahydrofuran-ethanol-water azeotropic system | 扬州贝尔新环境科技有限公司 | 2022-10-14 | — | — | CN | claimed |
| CN-115093303-A | Device and method for separating methanol-acetonitrile-benzene azeotrope system by extractive distillation | 大连理工大学 | 2022-09-23 | — | — | CN | claimed |
| CN-111888792-B | Device and method for separating tetrahydrofuran-ethanol-water azeotrope system by extractive distillation | 大连理工大学 | 2021-05-18 | — | — | CN | claimed |
| CN-111888792-A | Device and method for separating tetrahydrofuran-ethanol-water azeotrope system by extractive distillation | 大连理工大学 | 2020-11-06 | — | — | CN | claimed |
| US-20250228239-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | CORTEVA AGRISCIENCE LLC (US) | 2025-07-17 | — | — | US | disclosed |
| CN-119350434-B | Process synthesis method for cleavable linker Ala-Ala-Ala | 苏州共康医药科技有限公司 | 2025-04-29 | — | — | CN | disclosed |
| CN-119350434-A | Process synthesis method for cleavable linker Ala-Ala-Ala | 苏州共康医药科技有限公司 | 2025-01-24 | — | — | CN | disclosed |
| CN-221358593-U | System for separating tetrahydrofuran/cyclohexane/water ternary mixture by extractive distillation | 山东瑞博龙化工科技股份有限公司 | 2024-07-19 | — | — | CN | disclosed |
| CN-118290368-A | Method for separating tetrahydrofuran-ethanol-water-acetonitrile azeotropic system by extractive distillation | 天津仁爱学院 | 2024-07-05 | — | — | CN | disclosed |
| US-4696923-A | THIENAMYCIN ANTIBIOTICS, BACTERICIDES | MERCK & CO., INC. (US) | 1987-09-29 | — | — | US | disclosed |
| EP-0050334-B1 | 2-CARBAMIMIDOYL-6-SUBSTITUTED-1-CARBADETHIAPEN-2-EM-3-CARBOXYLIC ACIDS, A PROCESS FOR PREPARING AND AN ANTIBIOTIC COMPOSITION COMPRISING THE SAME | MERCK & CO. INC. (US) | 1987-06-10 | — | — | EP | disclosed |
| EP-0161541-A1 | 6-[1-Hydroxyethyl]-2-SR8-1-methyl-1-carba-dethiapen-2-em-3-carboxylic acids | MERCK & CO. INC. (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0160876-A1 | 1-Hetero-6-/1-Hydroxyethyl/-2-SR8-1-carbadethiapen-2-EM-3-carboxylic acids | MERCK & CO. INC. (US) | 1985-11-13 | — | — | EP | disclosed |
| EP-0071908-A1 | 1-, and 1,1-disubstituted-6-substituted-2-carbamimidoyl-1-carbadethiapen-2-em-3-carboxylic acids, a process for preparing and an antibiotic composition containing the same | MERCK & CO. INC. (US) | 1983-02-16 | — | — | EP | disclosed |
| EP-0050334-A1 | 2-Carbamimidoyl-6-substituted-1-carbadethiapen-2-em-3-carboxylic acids, a process for preparing and an antibiotic composition comprising the same | MERCK & CO. INC. (US) | 1982-04-28 | — | — | EP | disclosed |