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.
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 SCHEMBL8102706 | 1.00 | MEN1 (0.67) | — | |
| Water SCHEMBL3597569 | 1.00 | — | — | |
| Water SCHEMBL2587821 | 1.00 | — | — | |
| Water SCHEMBL708617 | 0.94 | MEN1 (0.75) | — | |
| Water SCHEMBL2590832 | 0.94 | MEN1 (0.75) | — | |
| Water SCHEMBL28478211 | 0.94 | MEN1 (0.75) | — | |
| Water SCHEMBL28398822 | 0.94 | MEN1 (0.75) | — | |
| Water SCHEMBL10896609 | 0.94 | MEN1 (0.75) | — | |
| Water SCHEMBL10566608 | 0.94 | MEN1 (0.75) | — | |
| Water SCHEMBL27601262 | 0.94 | MEN1 (0.75) | — |
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 150 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119951556-A | Iron-based mesoporous molecular sieve catalyst and preparation method and application thereof | 中国石油化工股份有限公司 | 2025-05-09 | — | — | CN | claimed |
| CN-119823406-A | Scandium-based MOF crystal material, preparation method and application thereof | 中国人民解放军陆军工程大学 | 2025-04-15 | — | — | CN | claimed |
| CN-119601693-A | Rare earth doped Pt-based high-entropy intermetallic compound, preparation and application | 吉林大学 | 2025-03-11 | — | — | CN | claimed |
| CN-119327471-A | CO used at low temperature2Methanation metal oxide nano island modified nickel-based catalyst and preparation method and application thereof | 湖北智慧绿碳能源科技有限公司 | 2025-01-21 | — | — | CN | claimed |
| CN-116870916-B | Metal/metal oxide composite catalyst and preparation method and application thereof | 华北电力大学 | 2024-12-27 | — | — | CN | claimed |
| CN-116899563-B | Metal oxide supported metal composite catalyst and preparation method and application thereof | 华北电力大学 | 2024-12-27 | — | — | CN | claimed |
| CN-119121304-A | Doped zirconium dioxide/copper oxide composite catalyst and preparation method and application thereof | 浙江大学 | 2024-12-13 | — | — | CN | claimed |
| CN-118702484-A | Light-transmitting brick and preparation method thereof | 王安旭 | 2024-09-27 | — | — | CN | claimed |
| CN-118324179-A | Scandium-cerium-ytterbium doped zirconia powder material and preparation method and application thereof | 广东伽瓦纳米科技有限公司 | 2024-07-12 | — | — | CN | claimed |
| CN-116217216-B | Lanthanum ferrite ceramic powder with variable solar absorptivity, and preparation method and application thereof | 上海交通大学 | 2024-05-14 | — | — | CN | claimed |
| CN-116870916-A | Metal/metal oxide composite catalyst and preparation method and application thereof | 华北电力大学 | 2023-10-13 | — | — | CN | claimed |
| CN-116832838-A | Catalyst for preparing propylene by dehydrogenating propane under sulfur-containing condition and preparation method | 孝感博镧铕新材料有限公司 | 2023-10-03 | — | — | CN | claimed |
| CN-116603572-A | Catalyst for preparing propylene by dehydrogenating propane under sulfur-containing condition and preparation method | 王艺霖 | 2023-08-18 | — | — | CN | claimed |
| CN-114618441-B | Controllable preparation method of MIL material and application of MIL material in separation and enrichment of polyalcohol | 中国科学院大连化学物理研究所 | 2023-07-04 | — | — | CN | claimed |
| CN-116212882-A | Novel layered copper-based solid Fenton catalyst and preparation method and application thereof | 中国科学院生态环境研究中心 | 2023-06-06 | — | — | CN | claimed |
| CN-116217216-A | Lanthanum ferrite ceramic powder with variable solar absorptivity, and preparation method and application thereof | 上海交通大学 | 2023-06-06 | — | — | CN | claimed |
| CN-114609198-B | Rare earth element doping and precious metal modification-based tin oxide-based hydrogen sensing material and preparation method and application thereof | 兰州大学 | 2022-08-19 | — | — | CN | claimed |
| CN-114618441-A | Controllable preparation method of MIL material and application of MIL material in separation and enrichment of polyhydric alcohol | 中国科学院大连化学物理研究所 | 2022-06-14 | — | — | CN | claimed |
| CN-114609198-A | Tin oxide-based hydrogen sensing material based on rare earth element doping and precious metal modification as well as preparation method and application thereof | 兰州大学 | 2022-06-10 | — | — | CN | claimed |
| CN-111253351-A | Controllable preparation of MIL material and application of MIL material in separation and enrichment of furan compound | 中国科学院大连化学物理研究所 | 2020-06-09 | — | — | CN | claimed |