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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.33 |
| ▸ | PTGS1 known ✓ | P23219 | 2/20 | 0.31 |
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.31 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.31 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.31 |
| ▸ | PTGS2 known ✓ | P35354 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.94 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 SCHEMBL27537650 | 1.00 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| SCHEMBL1607479 | 0.97 | — | — | |
| SCHEMBL7479399 | 0.97 | ALOX15 (1.00) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| SCHEMBL28162592 | 0.94 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| SCHEMBL27561506 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL28553518 | 0.94 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| Hydrochloric Acid SCHEMBL5186835 | 0.94 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| Bromide SCHEMBL3911094 | 0.94 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| Benzene SCHEMBL27362418 | 0.94 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A | |
| SCHEMBL28125487 | 0.94 | ALOX15 (0.94) | ALOX15ALDH1A1MAPTKDM4ERAB9A |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109689717-A | Water dispersion and its manufacturing method and image forming method | 富士胶片株式会社 | 2019-04-26 | — | — | CN | disclosed |
| CN-109196063-A | Water dispersion and its manufacturing method and image forming method | 富士胶片株式会社 | 2019-01-11 | — | — | CN | disclosed |
| CN-108698424-A | Lithographic printing plate precursor for on-press development, method for producing lithographic printing plate, and lithographic printing method | 富士胶片株式会社 | 2018-10-23 | — | — | CN | disclosed |
| CN-108699372-A | Ink composition, ink set, image recording method, and method for producing ink composition | 富士胶片株式会社 | 2018-10-23 | — | — | CN | disclosed |
| CN-108603024-A | Water dispersion, method for producing same, and image forming method | 富士胶片株式会社 | 2018-09-28 | — | — | CN | disclosed |
| CN-108602262-A | Granular building material | 惠普发展公司，有限责任合伙企业 | 2018-09-28 | — | — | CN | disclosed |
| CN-108541261-A | Water dispersion, method for producing same, and image forming method | 富士胶片株式会社 | 2018-09-14 | — | — | CN | disclosed |
| CN-103917919-B | Lithographic printing plate precursors for on-press development | 伊斯曼柯达公司 | 2017-07-14 | — | — | CN | disclosed |
| CN-103917919-A | Lithographic printing plate precursors for on-press development | EASTMAN KODAK CO | 2014-07-09 | — | — | CN | disclosed |
| CN-101884014-B | Imageable elements with components having 1h-tetrazole groups | EASTMAN KODAK CO | 2013-09-18 | — | — | CN | disclosed |
| CN-101296798-A | Multilayer imageable element containing epoxy resin | EASTMAN KODAK CO (US) | 2008-10-29 | — | — | CN | disclosed |
| CN-101283311-A | Radiation-sensitive compositions and imageable materials | EASTMAN KODAK CO (US) | 2008-10-08 | — | — | CN | disclosed |
| CN-101133453-A | Color forming compositions with improved marking sensitivity and image contrast and associated methods | HEWLETT PACKARD DEVELOPMENT CO (US) | 2008-02-27 | — | — | CN | disclosed |
| CN-101048281-A | Solvent Resistant Imageable Elements | EASTMAN KODAK CO (US) | 2007-10-03 | — | — | CN | disclosed |
| CN-1972803-A | Imageable element with solvent-resistant polymeric binder | EASTMAN KODAK CO (US) | 2007-05-30 | — | — | CN | disclosed |
| CN-1946753-A | Positive-working, thermally sensitive imageable element | EASTMAN KODAK CO (US) | 2007-04-11 | — | — | CN | disclosed |
| CN-1132027-C | Multilayer infrared reflective optical body | MINNESOTA MINING AND MANUFACTURING CO. (US) | 2003-12-24 | — | — | CN | disclosed |
| CN-1285922-A | Multilayer infrared refleccting optical body | MINNESOTA MINING & MFG (US) | 2001-02-28 | — | — | CN | disclosed |
| CN-1260796-A | Alkaloid halide salts of swainsonine and methods of use | GLYCODESIGN INC (CA) | 2000-07-19 | — | — | CN | disclosed |
| CN-1158660-A | Laser-applicable thermosensitive element | IMERSON CO (US) | 1997-09-03 | — | — | CN | disclosed |