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 SCHEMBL1951864 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL355868 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL1701009 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL435328 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL4352741 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL433643 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL28453085 | 0.94 | MEN1 (0.60) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL2590832 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| SCHEMBL4825937 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| SCHEMBL72025 | 0.94 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114904515-B | Manganese-based nano enzyme catalyst and preparation method and application thereof | 安徽工业大学 | 2024-04-26 | — | — | CN | claimed |
| CN-115785037-B | Green synthesis method for preparing 2, 5-furandicarboxylic acid by catalyzing serial oxidation of 5-hydroxymethylfurfural | 安徽工业大学 | 2024-03-29 | — | — | CN | claimed |
| CN-115676903-B | Preparation of soec symmetrical electrode material and electrolysis CO thereof 2 Application of | 南京信息工程大学 | 2024-02-20 | — | — | CN | claimed |
| CN-115676903-A | Preparation of soec symmetrical electrode material and electrolysis of CO 2 Applications of | 南京信息工程大学 | 2023-02-03 | — | — | CN | claimed |
| CN-119082767-A | Symmetrical solid oxide electrolytic cell electrode material and preparation method and application thereof | 南京信息工程大学 | 2024-12-06 | — | — | CN | disclosed |
| CN-118384852-A | Deep desulfurization adsorbent for coke oven gas, preparation method and application | 中国科学院山西煤炭化学研究所 | 2024-07-26 | — | — | CN | disclosed |
| CN-114904515-B | Manganese-based nano enzyme catalyst and preparation method and application thereof | 安徽工业大学 | 2024-04-26 | — | — | CN | disclosed |
| CN-115785037-B | Green synthesis method for preparing 2, 5-furandicarboxylic acid by catalyzing serial oxidation of 5-hydroxymethylfurfural | 安徽工业大学 | 2024-03-29 | — | — | CN | disclosed |
| CN-115676903-B | Preparation of soec symmetrical electrode material and electrolysis CO thereof 2 Application of | 南京信息工程大学 | 2024-02-20 | — | — | CN | disclosed |
| CN-115676903-B | Preparation of soec symmetrical electrode material and electrolysis CO thereof 2 Application of | 南京信息工程大学 | 2024-02-20 | — | — | CN | disclosed |
| CN-116474554-A | Low concentration methane oxidation method based on molecular sieve catalyst and ozone | 江苏上交碳中和科技有限公司 | 2023-07-25 | — | — | CN | disclosed |
| CN-115676903-A | Preparation of soec symmetrical electrode material and electrolysis of CO 2 Applications of | 南京信息工程大学 | 2023-02-03 | — | — | CN | disclosed |
| CN-115676903-A | Preparation of soec symmetrical electrode material and electrolysis of CO 2 Applications of | 南京信息工程大学 | 2023-02-03 | — | — | CN | disclosed |
| US-10302368-B2 | Aliphatic materials and uses thereof in heating and cooling applications | ELEVANCE RENEWABLE SCIENCES, INC. (US) | 2019-05-28 | — | — | US | disclosed |
| US-20190033009-A1 | Aliphatic Materials and Uses Thereof in Heating and Cooling Applications | ELEVANCE RENEWABLE SCIENCES, INC. (US) | 2019-01-31 | — | — | US | disclosed |
| US-10036598-B2 | Aliphatic materials and uses thereof in heating and cooling applications | ELEVANCE RENEWABLE SCIENCES, INC. (US) | 2018-07-31 | — | — | US | disclosed |
| EP-3283595-A1 | ALIPHATIC MATERIALS AND USES THEREOF IN HEATING AND COOLING APPLICATIONS | Elevance Renewable Sciences, Inc. (US) | 2018-02-21 | — | — | EP | disclosed |
| WO-2016168527-A1 | ALIPHATIC MATERIALS AND USES THEREOF IN HEATING AND COOLING APPLICATIONS | ELEVANCE RENEWABLE SCIENCES, INC. (US) | 2016-10-20 | — | — | WO | disclosed |
| US-20160305716-A1 | Aliphatic Materials and Uses Thereof in Heating and Cooling Applications | ELEVANCE RENEWABLE SCIENCES, INC. (US) | 2016-10-20 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-10036598-B2 | Aliphatic materials and uses thereof in heating and cooling applications | SCD, FADS2, DECR1 | MEN1 3233/4885KMT2A 2712/4885CA5A 1332/4885 |
| US-20190033009-A1 | Aliphatic Materials and Uses Thereof in Heating and Cooling Applications | SCD, FADS2, DECR1 | MEN1 3233/4885KMT2A 2712/4885CA5A 1332/4885 |
| US-10302368-B2 | Aliphatic materials and uses thereof in heating and cooling applications | SCD, FADS2, DECR1 | MEN1 3233/4885KMT2A 2712/4885CA5A 1332/4885 |
| US-20160305716-A1 | Aliphatic Materials and Uses Thereof in Heating and Cooling Applications | SCD, FADS2, DECR1 | MEN1 3233/4885KMT2A 2712/4885CA5A 1332/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.