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 SCHEMBL219444 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL218426 | 1.00 | — | — | |
| Water SCHEMBL3891351 | 1.00 | — | — | |
| Water SCHEMBL72145 | 1.00 | MEN1 (0.67) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL28478211 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL2590832 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL28398822 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| SCHEMBL2198408 | 0.94 | MEN1 (0.75) | MEN1KMT2ACA5ACA5BTSHR | |
| Water SCHEMBL10896609 | 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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114904523-B | Method for preparing N-dimethyl aromatic amine by catalyzing nitroaromatic hydrocarbon and methanol | 华北电力大学 | 2023-05-26 | — | — | CN | claimed |
| CN-114904527-B | Method for preparing N-monomethyl aromatic amine compound by catalyzing methanol | 华北电力大学 | 2023-05-26 | — | — | CN | claimed |
| CN-110061251-B | Pyridyl triazine derivative polymer-based nitrogen-doped carbon catalyst and preparation method and application thereof | 湘潭大学 | 2020-10-16 | — | — | CN | claimed |
| CN-119864434-A | Non-noble metal catalyst for fuel cell and preparation method and application thereof | 合肥国轩高科动力能源有限公司 | 2025-04-22 | — | — | CN | disclosed |
| CN-118530461-A | Preparation method of ZIF-67 derived ultrathin two-dimensional carbon nanosheets | 桂林电子科技大学 | 2024-08-23 | — | — | CN | disclosed |
| CN-113262792-B | CoO-CeO 2 Photocatalyst and preparation method and application thereof | 广州大学 | 2022-09-30 | — | — | CN | disclosed |
| CN-114284484-A | Preparation method and application of cobalt-based MOF-loaded vanadium dioxide zinc ion battery positive electrode material | 王俊英 | 2022-04-05 | — | — | CN | disclosed |
| CN-113684493-A | Method for preparing efficient electrolytic water hydrogen evolution catalyst by chemical plating method | 中国科学院过程工程研究所 | 2021-11-23 | — | — | CN | disclosed |
| CN-113262792-A | CoO-CeO2Photocatalyst and preparation method and application thereof | 广州大学 | 2021-08-17 | — | — | CN | disclosed |
| CN-111547780-B | Metal vanadate compound co-doped high-nickel ternary precursor and preparation method thereof | 浙江帕瓦新能源股份有限公司 | 2021-07-13 | — | — | CN | disclosed |
| CN-112678927-A | Bifunctional electrocatalytic membrane capable of efficiently activating persulfate and catalyzing nitrate reduction and preparation method thereof | 东莞理工学院 | 2021-04-20 | — | — | CN | disclosed |
| CN-110803721-B | Preparation method of ternary precursor | 中南大学 | 2020-08-11 | — | — | CN | disclosed |
| CN-110803721-A | Preparation method of ternary precursor | 中南大学 | 2020-02-18 | — | — | CN | disclosed |
| CN-109718749-B | method for preparing ozone catalyst by stepped gradient temperature rise calcining method and application | 南京大学盐城环保技术与工程研究院 | 2019-12-13 | — | — | CN | disclosed |
| US-7842403-B2 | Antifriction coatings, methods of producing such coatings and articles including such coatings | ATOTECH DEUTSCHLAND GMBH (DE) | 2010-11-30 | — | — | US | disclosed |
| EP-1993740-B1 | ANTIFRICTION COATINGS, METHODS OF PRODUCING SUCH COATINGS AND ARTICLES INCLUDING SUCH COATINGS | ATOTECH DEUTSCHLAND GMBH (DE) | 2010-05-19 | — | — | EP | disclosed |
| EP-1993740-A2 | ANTIFRICTION COATINGS, METHODS OF PRODUCING SUCH COATINGS AND ARTICLES INCLUDING SUCH COATINGS | ATOTECH DEUTSCHLAND GMBH (DE) | 2008-11-26 | — | — | EP | disclosed |
| WO-2007100486-A2 | ANTIFRICTION COATINGS, METHODS OF PRODUCING SUCH COATINGS AND ARTICLES INCLUDING SUCH COATINGS | ATOTECH DEUTSCHLAND GMBH (DE) | 2007-09-07 | — | — | WO | disclosed |
| US-20070196632-A1 | Antifriction coatings, methods of producing such coatings and articles including such coatings | ATOTECH DEUTSCHLAND GMBH & CO. KG (F/K/A ATOTECH DEUTSCHLAND GMBH) (DE) | 2007-08-23 | — | — | US | disclosed |
| US-6695458-B2 | EFFICIENCY | CANON KABUSHIKI KAISHA (JP) | 2004-02-24 | — | — | US | disclosed |