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 | 3/20 | 0.47 |
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.45 |
| ▸ | GSK3B known ✓ | P49841 | 1/20 | 0.41 |
| ▸ | TYMS known ✓ | P04818 | 1/20 | 0.41 |
| ▸ | PARP1 known ✓ | P09874 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.54 |
| ▸ | MAOB | P27338 | 2/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CDC25B | P30305 | 2/20 | 0.47 |
| ▸ | S100A4 | P26447 | 2/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | APAF1 | O14727 | 1/20 | 0.45 |
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.45 |
| ▸ | TDP2 | O95551 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL855431 | 0.97 | MAOA (0.56) | MAOAMAOBCYP2A6CES1MEN1 | |
| SCHEMBL29385474 | 0.97 | MAOA (0.56) | MAOAMAOBCYP2A6CES1MEN1 | |
| SCHEMBL2686810 | 0.82 | CES1 (0.62) | MAOAMAOBCYP2A6CES1BCHE | |
| SCHEMBL31157901 | 0.82 | CES1 (0.62) | MAOAMAOBCYP2A6CES1BCHE | |
| Acetic Acid SCHEMBL29684240 | 0.82 | NOTUM (0.52) | MAOAMAOBCYP2A6CES1MEN1 | |
| SCHEMBL29353311 | 0.80 | MAOA (0.74) | MAOAMAOBCYP2A6CES1BCHE | |
| SCHEMBL1268680 | 0.80 | MAOA (0.74) | MAOAMAOBCYP2A6CES1BCHE | |
| SCHEMBL24746 | 0.80 | MAOA (0.74) | MAOAMAOBCYP2A6CES1BCHE | |
| SCHEMBL31454252 | 0.78 | MAOA (0.71) | MAOAMAOBCYP2A6CES1BCHE | |
| SCHEMBL16552853 | 0.78 | MAOA (0.71) | MAOAMAOBCYP2A6CES1BCHE |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9045654-B2 | Multilayer articles capable of forming color images | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-06-02 | — | — | US | claimed |
| US-8411120-B2 | Generation of color images | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2013-04-02 | — | — | US | claimed |
| US-20110121557-A1 | MULTILAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY | 2011-05-26 | — | — | US | claimed |
| US-20110063392-A1 | GENERATION OF COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY | 2011-03-17 | — | — | US | claimed |
| EP-2280823-A2 | GENERATION OF COLOR IMAGES | 3M Innovative Properties Company (US) | 2011-02-09 | — | — | EP | claimed |
| WO-2009140088-A1 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-11-19 | — | — | WO | claimed |
| WO-2009140083-A2 | GENERATION OF COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-11-19 | — | — | WO | claimed |
| EP-2588317-B1 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES AND METHODS OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES CO (US) | 2020-03-18 | — | — | EP | disclosed |
| US-9045654-B2 | Multilayer articles capable of forming color images | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-06-02 | — | — | US | disclosed |
| US-8975012-B2 | Multi-layer articles capable of forming color images and methods of forming color images | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-03-10 | — | — | US | disclosed |
| US-8975011-B2 | Multi-layer articles capable of forming color images and method of forming color images | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-03-10 | — | — | US | disclosed |
| EP-2588317-A2 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES AND METHODS OF FORMING COLOR IMAGES | 3M Innovative Properties Company (US) | 2013-05-08 | — | — | EP | disclosed |
| EP-2588316-A2 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES AND METHODS OF FORMING COLOR IMAGES | 3M Innovative Properties Company (US) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012012118-A2 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES AND METHODS OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2012-01-26 | — | — | WO | disclosed |
| WO-2012003247-A2 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES AND METHODS OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2012-01-05 | — | — | WO | disclosed |
| US-20110121557-A1 | MULTILAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY | 2011-05-26 | — | — | US | disclosed |
| US-20110063392-A1 | GENERATION OF COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY | 2011-03-17 | — | — | US | disclosed |
| EP-2280823-A2 | GENERATION OF COLOR IMAGES | 3M Innovative Properties Company (US) | 2011-02-09 | — | — | EP | disclosed |
| WO-2009140088-A1 | MULTI-LAYER ARTICLES CAPABLE OF FORMING COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-11-19 | — | — | WO | disclosed |
| WO-2009140083-A2 | GENERATION OF COLOR IMAGES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-11-19 | — | — | WO | disclosed |