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.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.44 |
| ▸ | ESR1 known ✓ | P03372 | 2/20 | 0.42 |
| ▸ | ESR2 known ✓ | Q92731 | 2/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.55 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | AKT2 | P31751 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | PDE2A | O00408 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5872061 | 0.97 | KCNN4 (0.52) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Hydrochloric Acid SCHEMBL8388827 | 0.97 | KCNN4 (0.52) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Hydrochloric Acid SCHEMBL8387706 | 0.97 | KCNN4 (0.52) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| SCHEMBL6145 | 0.97 | KCNN4 (0.58) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Bromide SCHEMBL414533 | 0.94 | KCNN4 (0.55) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Methylamine SCHEMBL20916863 | 0.94 | KCNN4 (0.55) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Fluoride SCHEMBL634655 | 0.94 | KCNN4 (0.55) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Iodide SCHEMBL6672017 | 0.94 | KCNN4 (0.55) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Hydrochloric Acid SCHEMBL8387827 | 0.94 | KCNN4 (0.55) | KCNN4TAAR1AKT1AKT2MAPK1 | |
| Bromide SCHEMBL3629993 | 0.94 | KCNN4 (0.55) | KCNN4TAAR1AKT1AKT2MAPK1 |
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 111 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12419942-B2 | Use of the Salmonella spp type III secretion proteins as a protective vaccination | UNIVERSITY OF KANSAS (US) | 2025-09-23 | — | — | US | disclosed |
| CN-119730834-A | Personal care compositions containing spherical silicone elastomer fine particles | 迈图高新材料公司 | 2025-03-28 | — | — | CN | disclosed |
| US-12201715-B2 | Personal care composition containing spherical silicone elastomer fine particles | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2025-01-21 | — | — | US | disclosed |
| US-12102679-B2 | FcRn-targeted therapeutics for the treatment of antibody-mediated autoimmune and albumin-mediated disease | UNIVERSITY OF MARYLAND, COLLEGE PARK (US) | 2024-10-01 | — | — | US | disclosed |
| WO-2024039563-A1 | PERSONAL CARE COMPOSITION CONTAINING SPHERICAL SILICONE ELASTOMER FINE PARTICLES | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2024-02-22 | — | — | WO | disclosed |
| US-20240058255-A1 | PERSONAL CARE COMPOSITION CONTAINING SPHERICAL SILICONE ELASTOMER FINE PARTICLES | MOMENTIVE PERFORMANCE MATERIALS INC. | 2024-02-22 | — | — | US | disclosed |
| US-20230181723-A1 | FcRn-TARGETED THERAPEUTICS FOR THE TREATMENT OF ANTIBODY-MEDIATED AUTOIMMUNE AND ALBUMIN-MEDIATED DISEASE | UNIVERSITY OF MARYLAND, COLLEGE PARK | 2023-06-15 | — | — | US | disclosed |
| CN-114470198-B | IgY spray of SARS-CoV-2 egg yolk neutralization antibody for preventing and treating new coronal pneumonia | 上海博满生物科技有限公司 | 2023-05-05 | — | — | CN | disclosed |
| US-20230136602-A1 | Use of the Salmonella SPP Type III Secretion Proteins as a Protective Vaccination | UNIVERSITY OF KANSAS | 2023-05-04 | — | — | US | disclosed |
| CN-115667339-A | Aqueous polyurethane resin dispersion | 爱克发有限公司 | 2023-01-31 | — | — | CN | disclosed |
| WO-1998038859-A1 | SULFONYL DIVALENT ARYL OR HETEROARYL HYDROXAMIC ACID COMPOUNDS | MONSANTO COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |
| WO-1998039316-A1 | N-HYDROXY 4-SULFONYL BUTANAMIDE COMPOUNDS | MONSANTO COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |
| WO-1998039315-A1 | AROMATIC SULFONYL ALPHA-CYCLOAMINO HYDROXAMIC ACID COMPOUNDS | MONSANTO COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |
| WO-1998039313-A1 | THIOARYL SULFONAMIDE HYDROXAMIC ACID COMPOUNDS | MONSANTO COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |
| WO-1998039326-A1 | AROMATIC SULFONYL ALPHA-HYDROXY HYDROXAMIC ACID COMPOUNDS | MONSANTO COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |
| WO-1998003164-A1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1998-01-29 | — | — | WO | disclosed |
| EP-0482480-B1 | Surface-treating agent and surface-treated EPDM article | TOSHIBA SILICONE (JP) | 1995-01-11 | — | — | EP | disclosed |
| EP-0482480-A1 | Surface-treating agent and surface-treated EPDM article | TOSHIBA SILICONE CO., LTD. (JP) | 1992-04-29 | — | — | EP | disclosed |
| EP-0469613-A2 | Organopolysiloxane/acrylate ester copolymer emulsion | Dow Corning Toray Silicone Company, Limited (JP) | 1992-02-05 | — | — | EP | disclosed |
| US-4622335-A | AGRICULTURE | BAYER AKTIENGESELLSCHAFT (DE) | 1986-11-11 | — | — | US | disclosed |