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 | |
|---|---|---|---|---|
| SCHEMBL1938 | 0.94 | — | — | |
| SCHEMBL29818845 | 0.94 | TSHR (1.00) | — | |
| SCHEMBL7249115 | 0.89 | — | — | |
| SCHEMBL9193935 | 0.89 | — | — | |
| SCHEMBL8378298 | 0.89 | — | — | |
| SCHEMBL6223954 | 0.89 | — | — | |
| SCHEMBL8377677 | 0.89 | — | — | |
| SCHEMBL3422882 | 0.89 | TSHR (0.89) | — | |
| Lithium SCHEMBL929003 | 0.89 | TSHR (0.89) | — | |
| SCHEMBL8379533 | 0.89 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10135085-B2 | Flow battery with hydrated ion-exchange membrane having maximum water domain cluster sizes | UNITED TECHNOLOGIES CORPORATION (US) | 2018-11-20 | — | — | US | claimed |
| EP-2997617-B1 | FLOW BATTERY WITH HYDRATED ION-EXCHANGE MEMBRANE HAVING MAXIMUM WATER DOMAIN CLUSTER SIZES | UNITED TECHNOLOGIES CORP (US) | 2018-10-10 | — | — | EP | claimed |
| US-20160126579-A1 | FLOW BATTERY WITH HYDRATED ION-EXCHANGE MEMBRANE HAVING MAXIMUM WATER DOMAIN CLUSTER SIZES | RTX CORPORATION | 2016-05-05 | — | — | US | claimed |
| EP-2997617-A1 | FLOW BATTERY WITH HYDRATED ION-EXCHANGE MEMBRANE HAVING MAXIMUM WATER DOMAIN CLUSTER SIZES | United Technologies Corporation (US) | 2016-03-23 | — | — | EP | claimed |
| WO-2014185909-A1 | FLOW BATTERY WITH HYDRATED ION-EXCHANGE MEMBRANE HAVING MAXIMUM WATER DOMAIN CLUSTER SIZES | UNITED TECHNOLOGIES CORPORATION (US) | 2014-11-20 | — | — | WO | claimed |
| WO-2024010179-A1 | POLYSTYRENE POLYMER COMPRISING BIFUNCTIONAL GROUP, POLYMER ELECTROLYTE MEMBRANE COMPRISING SAME, AND ELECTRONIC DEVICE | 포항공과대학교 산학협력단 | 2024-01-11 | — | — | WO | disclosed |
| CN-111951899-A | Graphic neural network force field calculation algorithm for molecular dynamics computer simulation | 罗伯特·博世有限公司 | 2020-11-17 | — | — | CN | disclosed |
| US-20080176965-A1 | Enhancing proton conductivity of proton exchange membranes | GM GLOBAL TECHNOLOGY OPERATIONS, INC. (US) | 2008-07-24 | — | — | US | disclosed |
| US-7183017-B2 | Composite polymer electrolytes for proton exchange membrane fuel cells | HOKU SCIENTIFIC, INC. - A DELAWARE CORP. (US) | 2007-02-27 | — | — | US | disclosed |
| US-7008971-B2 | Physicochemical properties and superior fuel cell performance in hydrogen oxygen fuel cells | HOKU SCIENTIFIC, INC. (US) | 2006-03-07 | — | — | US | disclosed |
| US-20050282051-A1 | Integrated honeycomb solid electrolyte fuel cells | ZHOU ZHIGANG | 2005-12-22 | — | — | US | disclosed |
| US-20050244697-A1 | Composite polymer electrolytes for proton exchange membrane fuel cells | ALTERNATIVE ENERGY RESOURCES, INC. | 2005-11-03 | — | — | US | disclosed |
| US-20040048129-A1 | Composite polymer electrolytes for proton exchange membrane fuel cells | HOKU CORPORATION | 2004-03-11 | — | — | US | disclosed |
| EP-0556232-A1 | COMPOSITE MEMBRANE FOR FACILITATED TRANSPORT PROCESSES | W.L. GORE & ASSOCIATES, INC. (US) | 1993-08-25 | — | — | EP | disclosed |
| WO-1992007649-A1 | COMPOSITE MEMBRANE FOR FACILITATED TRANSPORT PROCESSES | W.L. GORE & ASSOCIATES, INC. (US) | 1992-05-14 | — | — | WO | disclosed |
| US-5082472-A | Polytetrafluoroethylene and ion exchange resin | W. L. GORE & ASSOCIATES, INC. | 1992-01-21 | — | — | US | disclosed |