Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-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 | |
|---|---|---|---|---|
| SCHEMBL28258609 | 1.00 | — | — | |
| SCHEMBL27468099 | 1.00 | — | — | |
| Methane SCHEMBL23088734 | 0.00 | — | — | |
| Methane SCHEMBL23795058 | 0.00 | — | — | |
| SCHEMBL23528133 | 0.00 | — | — | |
| SCHEMBL23461972 | 0.00 | — | — | |
| SCHEMBL25435013 | 0.00 | — | — | |
| Phosphine SCHEMBL25436453 | 0.00 | — | — | |
| Water SCHEMBL25437472 | 0.00 | — | — | |
| SCHEMBL23462191 | 0.00 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109569508-A | Micro-pore carbon material separates the nitrogen in association and nonassociated gas stream | 墨西哥石油研究院 | 2019-04-05 | — | — | CN | claimed |
| CN-108206229-A | The production method of ITO pattern in a kind of GaN base LED | 山东浪潮华光光电子股份有限公司 | 2018-06-26 | — | — | CN | claimed |
| CN-102816805-B | Novel method for improving saccharic acid conversion rate of L-glutamic acid | JILIN COFCO BIOCHEMICAL TECHNOLOGY CO LTD | 2014-04-02 | — | — | CN | claimed |
| CN-102816805-A | Novel method for improving saccharic acid conversion rate of L-glutamic acid | JILIN COFCO BIOCHEMICAL TECHNOLOGY CO LTD | 2012-12-12 | — | — | CN | claimed |
| CN-118109688-A | Zinc-oxygen pressure leaching high-sulfur slag triple pyrogenic process recycling treatment method | 呼伦贝尔驰宏矿业有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-108206229-A | The production method of ITO pattern in a kind of GaN base LED | 山东浪潮华光光电子股份有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-107437502-A | The method that oxidation processes recess gate structure is used during recess etch processing procedure | 格罗方德半导体公司 | 2017-12-05 | — | — | CN | disclosed |
| CN-102816805-B | Novel method for improving saccharic acid conversion rate of L-glutamic acid | JILIN COFCO BIOCHEMICAL TECHNOLOGY CO LTD | 2014-04-02 | — | — | CN | disclosed |
| CN-102816805-A | Novel method for improving saccharic acid conversion rate of L-glutamic acid | JILIN COFCO BIOCHEMICAL TECHNOLOGY CO LTD | 2012-12-12 | — | — | CN | disclosed |
| CN-101508014-B | Technological process capable reducing cross crack ratio of ferritic stainless steel continuous casting billet | SHANXI TAIYUAN STEEL STAINLESS STEEL CO LTD | 2012-01-18 | — | — | CN | disclosed |
| CN-101508014-A | Technological process capable reducing cross crack ratio of ferritic stainless steel continuous casting billet | SHANXI TAIYUAN STEEL STAINLESS (CN) | 2009-08-19 | — | — | CN | disclosed |