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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 known ✓ | P35372 | 2/20 | 0.46 |
| ▸ | OPRD1 known ✓ | P41143 | 2/20 | 0.46 |
| ▸ | OPRK1 known ✓ | P41145 | 2/20 | 0.46 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 3/20 | 0.43 |
| ▸ | CTSB | P07858 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 2/20 | 0.42 |
| ▸ | CDYL2 | Q8N8U2 | 2/20 | 0.42 |
| ▸ | CBX7 | O95931 | 1/20 | 0.41 |
| ▸ | CBX8 | Q9HC52 | 1/20 | 0.41 |
| ▸ | GRPR | P30550 | 1/20 | 0.41 |
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 SCHEMBL1433025 | 1.00 | OPRM1 (0.46) | OPRM1OPRD1OPRK1GPR139CTSL | |
| Water SCHEMBL28629638 | 1.00 | OPRM1 (0.46) | OPRM1OPRD1OPRK1GPR139CTSL | |
| SCHEMBL17925467 | 0.99 | OPRM1 (0.46) | OPRM1OPRD1OPRK1GPR139CTSL | |
| SCHEMBL1275443 | 0.99 | OPRM1 (0.46) | OPRM1OPRD1OPRK1GPR139CTSL | |
| SCHEMBL1674833 | 0.99 | OPRM1 (0.46) | OPRM1OPRD1OPRK1GPR139CTSL | |
| Hydrochloric Acid SCHEMBL30196080 | 0.98 | OPRM1 (0.46) | OPRM1OPRD1OPRK1GPR139CTSL | |
| SCHEMBL316943 | 0.92 | OPRD1 (0.42) | OPRM1OPRD1OPRK1GRPR | |
| Hippuric Acid SCHEMBL1838491 | 0.92 | OPRD1 (0.49) | OPRM1OPRD1OPRK1CTSBCDYL2 | |
| SCHEMBL11330795 | 0.91 | OPRM1 (0.42) | OPRM1OPRD1OPRK1CTSBMME | |
| SCHEMBL11330871 | 0.89 | OPRM1 (0.40) | OPRM1OPRD1OPRK1CTSBMME |
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 |
|---|---|---|---|---|---|---|---|
| CN-101421390-B | Lactobacillus helveticus strains without lactose fermentation | GERVAIS DANONE SA | 2013-03-06 | — | — | CN | disclosed |
| US-8323951-B2 | Strains of Lactobacillus helveticus which do not ferment lactose | COMPAGNIE GERVAIS DANONE (FR) | 2012-12-04 | — | — | US | disclosed |
| EP-1991661-B1 | STRAINS OF LACTOBACILLUS HELVETICUS WHICH DO NOT FERMENT LACTOSE | GERVAIS DANONE SA (FR) | 2012-01-18 | — | — | EP | disclosed |
| EP-1820405-B1 | New strain of Lactobacillus Helveticus | GERVAIS DANONE SA (FR) | 2011-03-30 | — | — | EP | disclosed |
| CN-101421390-A | Lactobacillus helveticus strains without lactose fermentation | GERVAIS DANONE SA (FR) | 2009-04-29 | — | — | CN | disclosed |
| US-20090088391-A1 | Strains of Lactobacillus Helveticus which do not Ferment Lactose | COMPAGNIE GERVAIS DANONE (FR) | 2009-04-02 | — | — | US | disclosed |
| EP-1820850-B1 | New strains of Lactobacillus helveticus | GERVAIS DANONE SA (FR) | 2009-02-25 | — | — | EP | disclosed |
| EP-1820849-B1 | New strains of Lactobacillus helveticus | GERVAIS DANONE SA (FR) | 2009-01-21 | — | — | EP | disclosed |
| EP-1991661-A2 | NON-LACTOSE FERMENTING LACTOBACILLUS HELVETICUS | COMPAGNIE GERVAIS DANONE (FR) | 2008-11-19 | — | — | EP | disclosed |
| WO-2007096495-A1 | NOVEL STRAINS OF LACTOBACILLUS HELVETICUS | COMPAGNIE GERVAIS DANONE (FR) | 2007-08-30 | — | — | WO | disclosed |
| WO-2007096498-A1 | NOVEL STRAINS OF LACTOBACILLUS HELVETICUS | COMPAGNIE GERVAIS DANONE (FR) | 2007-08-30 | — | — | WO | disclosed |
| WO-2007096497-A1 | NOVEL STRAINS OF LACTOBACILLUS HELVETICUS | COMPAGNIE GERVAIS DANONE (FR) | 2007-08-30 | — | — | WO | disclosed |
| WO-2007096510-A2 | STRAINS OF LACTOBACILLUS HELVETICUSWHICH DO NOT FERMENT LACTOSE | COMPAGNIE GERVAIS DANONE (FR) | 2007-08-30 | — | — | WO | disclosed |
| EP-1820405-A1 | New strain of Lactobacillus Helveticus | Compagnie Gervais Danone (FR) | 2007-08-22 | — | — | EP | disclosed |
| EP-1820850-A1 | New strains of Lactobacillus helveticus | Compagnie Gervais Danone (FR) | 2007-08-22 | — | — | EP | disclosed |
| EP-1820849-A1 | New strains of Lactobacillus helveticus | Compagnie Gervais Danone (FR) | 2007-08-22 | — | — | EP | disclosed |