Fluoride Ion

Fluoride Ion

SCHEMBL6846212

O=P([O-])([O-])F.[F-].[Na+].[Ni+2]

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Fluoride Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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.

Compoundsimilaritytop predictedshared targets
Fluoride Ion SCHEMBL8500720 0.95
SCHEMBL31484897 0.95
Fluoride Ion SCHEMBL1708171 0.95 LMNA (0.38)
Fluoride Ion SCHEMBL17870658 0.91
Fluoride Ion SCHEMBL20723412 0.91
Fluoride Ion SCHEMBL10608996 0.91
SCHEMBL1615261 0.91 LMNA (0.40)
SCHEMBL9138380 0.91 LMNA (0.40)
SCHEMBL923986 0.91 SLC34A1 (0.39)
Sodium Monofluorophosphate SCHEMBL93758 0.91

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6770265-B2 FOR TREATING A DENTAL CAVITY DURING UNDERGOING RESTORATIVE FOR A DEFICIENT PART OF A TOOTH STRUCTURE IN THE DENTAL THERAPY GC CORPORATION (JP) 2004-08-03 US claimed
US-20030064035-A1 Tooth surface treatment material and tooth surface treatment method GC CORPORATION (JP) 2003-04-03 US claimed
EP-1297815-A1 Tooth surface treatment material GC Corporation (JP) 2003-04-02 EP claimed
US-6770265-B2 FOR TREATING A DENTAL CAVITY DURING UNDERGOING RESTORATIVE FOR A DEFICIENT PART OF A TOOTH STRUCTURE IN THE DENTAL THERAPY GC CORPORATION (JP) 2004-08-03 US disclosed
US-20030064035-A1 Tooth surface treatment material and tooth surface treatment method GC CORPORATION (JP) 2003-04-03 US disclosed
EP-1297815-A1 Tooth surface treatment material GC Corporation (JP) 2003-04-02 EP disclosed