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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
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 SCHEMBL28009846 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL3611723 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL4448554 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL10896609 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL2590832 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL28398822 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL28478211 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL708617 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| SCHEMBL194238 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL10566608 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR |
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 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116496507-B | Dy-MOF fluorescent probe material and preparation method and application thereof | 常州大学 | 2025-03-14 | — | — | CN | claimed |
| CN-115784850-B | Method for preparing diethyl ether as byproduct in production of m-ethoxyphenol | 万华化学集团股份有限公司 | 2024-02-27 | — | — | CN | claimed |
| CN-117586771-A | Single-phase white luminous fluorescent powder and preparation method thereof | 成都市第三人民医院 | 2024-02-23 | — | — | CN | claimed |
| CN-117145460-A | Tracer and preparation method and application thereof | 大庆中联信实石油科技开发有限公司 | 2023-12-01 | — | — | CN | claimed |
| CN-115110708-B | Ultrathin heat-insulating decorative composite integrated plate | 金彩螺新材料科技有限公司 | 2023-10-17 | — | — | CN | claimed |
| CN-116496507-A | Dy-MOF fluorescent probe material and preparation method and application thereof | 常州大学 | 2023-07-28 | — | — | CN | claimed |
| CN-115784850-A | Method for producing by-product diethyl ether by using m-ethoxyphenol | 万华化学集团股份有限公司 | 2023-03-14 | — | — | CN | claimed |
| CN-115110708-A | Ultra-thin type heat preservation and decoration composite integrated board | 金彩螺新材料科技有限公司 | 2022-09-27 | — | — | CN | claimed |
| CN-108192111-B | Pyridine acid metal organic framework white light material and preparation method thereof | 成都理工大学 | 2021-07-20 | — | — | CN | claimed |
| CN-109988185-B | Platinum dysprosium mixed metal compound with anti-tumor selectivity and preparation method thereof | 邵阳学院 | 2021-03-19 | — | — | CN | claimed |
| CN-111987220-A | Perovskite solar cell based on down-conversion layer and preparation method | 西安电子科技大学 | 2020-11-24 | — | — | CN | claimed |
| CN-120015459-A | Silicon oil base rare earth Dy3+Doping Fe3O4Magnetic fluid and preparation method thereof | 中国长江电力股份有限公司 | 2025-05-16 | — | — | CN | disclosed |
| CN-116496507-B | Dy-MOF fluorescent probe material and preparation method and application thereof | 常州大学 | 2025-03-14 | — | — | CN | disclosed |
| CN-118825307-A | Rare earth element doped carbon nitride supported noble metal electrocatalyst and preparation method and application thereof | 北京师范大学珠海校区 | 2024-10-22 | — | — | CN | disclosed |
| CN-115784850-B | Method for preparing diethyl ether as byproduct in production of m-ethoxyphenol | 万华化学集团股份有限公司 | 2024-02-27 | — | — | CN | disclosed |
| US-5837866-A | Phosphoramidite derivatives of macrocycles | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS (US) | 1998-11-17 | — | — | US | disclosed |
| WO-1998007733-A1 | NUCLEIC ACIDS INTERNALLY-DERIVATIZED WITH A TEXAPHYRIN METAL COMPLEX AND USES THEREOF | PHARMACYCLICS, INC. (US) | 1998-02-26 | — | — | WO | disclosed |
| US-5633354-A | Phosphoramidite derivatives of texaphyrins | PHARMACYCLICS, INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5565552-A | Method of expanded porphyrin-oligonucleotide conjugate synthesis | PHARMACYCLICS, INC. (US) | 1996-10-15 | — | — | US | disclosed |
| US-5484756-A | Hydrodesulfurization catalyst and preparation thereof | NIKKI-UNIVERSAL CO., LTD. (JP) | 1996-01-16 | — | — | US | disclosed |