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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 known ✓ | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 known ✓ | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 known ✓ | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 known ✓ | Q9BY41 | 1/20 | 0.33 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 5/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL976875 | 1.00 | CA4 (0.48) | CA4CASP1FFAR3HDAC3HDAC1 | |
| Water SCHEMBL333821 | 0.97 | CA4 (0.46) | CA4CASP1FFAR3HDAC3HDAC1 | |
| Water SCHEMBL5273801 | 0.97 | CA4 (0.52) | CA4CASP1FFAR3HDAC3HDAC1 | |
| Water SCHEMBL11047081 | 0.97 | CA4 (0.46) | CA4CASP1FFAR3HDAC3HDAC1 | |
| Water SCHEMBL11324780 | 0.97 | CA4 (0.46) | CA4CASP1FFAR3HDAC3HDAC1 | |
| Water SCHEMBL8091375 | 0.97 | CA4 (0.52) | CA4CASP1FFAR3HDAC3HDAC1 | |
| Water SCHEMBL6546245 | 0.97 | CA4 (0.52) | CA4CASP1FFAR3HDAC3HDAC1 | |
| SCHEMBL1389538 | 0.97 | CA4 (0.50) | CA4CASP1FFAR3HDAC3HDAC1 | |
| SCHEMBL15251308 | 0.94 | CA4 (0.48) | CA4CASP1FFAR3HDAC3HDAC1 | |
| SCHEMBL6669346 | 0.94 | CA4 (0.48) | CA4CASP1FFAR3HDAC3HDAC1 |
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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115976586-A | Positive and negative pulse electrolytic nickel-tungsten alloy solution, preparation method, electroplating method and nickel-tungsten alloy coating | 昆山一鼎工业科技有限公司 | 2023-04-18 | — | — | CN | claimed |
| EP-0186436-B1 | LIQUID CLEANSING COMPOSITION | WARNER-LAMBERT COMPANY (US) | 1992-03-18 | — | — | EP | claimed |
| US-4807649-A | WITH METAL SULFATED FATTY ALCOHOL DETERGENT, AMINO CARBOXYLATE OR PHOSPHONATE CHELATING AGENT, AND GELLING AGENT | WARNER-LAMBERT COMPANY (US) | 1989-02-28 | — | — | US | claimed |
| US-4701223-A | MIXTURE OF DETERGENT AND CHELATE COMPOUNDS | WARNER-LAMBERT COMPANY (US) | 1987-10-20 | — | — | US | claimed |
| EP-0186436-A2 | Liquid cleansing composition | WARNER-LAMBERT COMPANY (US) | 1986-07-02 | — | — | EP | claimed |
| US-3964832-A | Gel composition and adhesive stick | THE CARTER'S INK COMPANY (US) | 1976-06-22 | — | — | US | claimed |
| US-20250368817-A1 | THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF | TECHNO UMG CO LTD (JP) | 2025-12-04 | — | — | US | disclosed |
| EP-4656700-A1 | VIBRATION-DAMPING PROPERTY-IMPARTING MATERIAL, THERMOPLASTIC RESIN COMPOSITION, AND MOLDED ARTICLE | Techno-UMG Co., Ltd. (JP) | 2025-12-03 | — | — | EP | disclosed |
| US-20250320435-A1 | CLEANING AGENT COMPOSITION AND CLEANING METHOD | SHIKOKU CHEMICALS CORPORATION (JP) | 2025-10-16 | — | — | US | disclosed |
| US-20250162287-A1 | POLYMER INTERLAYERS WITH REDUCED SALTS | SOLUTIA INC. (US) | 2025-05-22 | — | — | US | disclosed |
| US-20250135449-A1 | WATER-SOLUBLE CHELATING POLYMER AND METHOD FOR PRODUCING SAME | TOSOH CORPORATION (JP) | 2025-05-01 | — | — | US | disclosed |
| EP-4476064-A1 | POLYMER INTERLAYERS WITH REDUCED SALTS | Solutia Inc. (US) | 2024-12-18 | — | — | EP | disclosed |
| EP-4474397-A1 | WATER-SOLUBLE CHELATING POLYMER AND METHOD FOR PRODUCING SAME | Tosoh Corporation (JP) | 2024-12-11 | — | — | EP | disclosed |
| EP-0186436-B1 | LIQUID CLEANSING COMPOSITION | WARNER-LAMBERT COMPANY (US) | 1992-03-18 | — | — | EP | disclosed |
| WO-1991011388-A1 | STABILIZATION OF AQUEOUS PEROXYGEN SOLUTIONS | UNITED STATES BORAX & CHEMICAL CORPORATION (US) | 1991-08-08 | — | — | WO | disclosed |
| US-4906553-A | Processing process for silver halide black and white photographic materials | FUJI PHOTO FILM CO., LTD. (JP) | 1990-03-06 | — | — | US | disclosed |
| US-4807649-A | WITH METAL SULFATED FATTY ALCOHOL DETERGENT, AMINO CARBOXYLATE OR PHOSPHONATE CHELATING AGENT, AND GELLING AGENT | WARNER-LAMBERT COMPANY (US) | 1989-02-28 | — | — | US | disclosed |
| US-4701223-A | MIXTURE OF DETERGENT AND CHELATE COMPOUNDS | WARNER-LAMBERT COMPANY (US) | 1987-10-20 | — | — | US | disclosed |
| EP-0213947-A2 | Graft copolymer, process for its production and composition containing it | RALSTON PURINA COMPANY (US) | 1987-03-11 | — | — | EP | disclosed |
| US-3964832-A | Gel composition and adhesive stick | THE CARTER'S INK COMPANY (US) | 1976-06-22 | — | — | US | disclosed |