Edetic Acid

Edetic Acid

SCHEMBL387222

O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O=C1c2ccccc2C(=O)c2c1ccc(O)c2O.[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 2/20 0.46
RAF1 known ✓ P04049 1/20 0.46
MAPT P10636 8/20 0.63
MEN1 O00255 7/20 0.63
KMT2A Q03164 7/20 0.63
ALDH1A1 P00352 5/20 0.63
MAPK1 P28482 4/20 0.63
MAOA P21397 4/20 0.63
MCL1 Q07820 3/20 0.63
KDM4E B2RXH2 3/20 0.63
CYP3A4 P08684 3/20 0.63
HPGD P15428 3/20 0.63
ALOX15 P16050 3/20 0.63
RECQL P46063 3/20 0.63
HSD17B10 Q99714 3/20 0.63
APEX1 P27695 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
BCL2 P10415 2/20 0.63
ALOX12 P18054 2/20 0.63
DAPK1 P53355 2/20 0.63

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.

Compoundsimilaritytop predictedshared targets
Edetic Acid SCHEMBL16937078 0.99 MAPT (0.61) MAPTMEN1KMT2AALDH1A1MAPK1
Edetic Acid SCHEMBL4005959 0.99 MAPT (0.61) MAPTMEN1KMT2AALDH1A1MAPK1
Edetic Acid SCHEMBL5608586 0.84 MAPT (0.63) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL21114402 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL29373337 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL4972786 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL18614 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL4249545 0.78 MAPT (0.83) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL10533977 0.78 MAPT (0.83) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL7839563 0.78 MAPT (0.96) MAPTMEN1KMT2AALDH1A1MAPK1

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 446 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115718097-A Detection reagent for fluorine ion online monitoring instrument and preparation method thereof 湖南环信科技有限公司 2023-02-28 CN claimed
US-11193883-B2 Kits for detecting content of fluoride ions in microsamples HARBIN MEDICAL UNIVERSITY (CN) 2021-12-07 US claimed
US-11041800-B2 Method for detecting content of fluoride ions in microsamples HARBIN MEDICAL UNIVERSITY (CN) 2021-06-22 US claimed
CN-108121113-B Optical unit and display device having the same 乐金显示有限公司 2021-05-14 CN claimed
CN-112700906-A Solidified high-conductivity silver paste prepared from particle-free conductive silver ink 江苏碳导材料科技有限公司 2021-04-23 CN claimed
US-20200080933-A1 KITS FOR DETECTING CONTENT OF FLUORIDE IONS IN MICROSAMPLES HARBIN MEDICAL UNIVERSITY (CN) 2020-03-12 US claimed
US-20200080932-A1 METHOD FOR DETECTING CONTENT OF FLUORIDE IONS IN MICROSAMPLES HARBIN MEDICAL UNIVERSITY (CN) 2020-03-12 US claimed
US-10401677-B2 Optical unit and display device having the same LG DISPLAY CO., LTD. (KR) 2019-09-03 US claimed
US-10401320-B2 Method of fabricating 3-dimensional transistor sensor, the sensor and sensor array thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2019-09-03 US claimed
US-20190072516-A1 METHOD OF FABRICATING 3-DIMENSIONAL TRANSISTOR SENSOR, THE SENSOR AND SENSOR ARRAY THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2019-03-07 US claimed
WO-2006112827-A1 RAPID ANALYSIS OF FUNCTIONAL FLUIDS THE LUBRIZOL CORPORATION (US) 2006-10-26 WO claimed
US-20060003459-A1 Adding boronic acid-derivative chiral receptor to indicator such as of alizarin red S, adding analyte such as alpha -hydroxyacid or amino acid, inspection of color with the naked eye, spectrographic measurement, or mathematical calculation UNIVERSITY OF TEXAS AT AUSTIN (US) 2006-01-05 US claimed
US-20050227369-A1 Rapid analysis of functional fluids THE LUBRIZOL CORPORATION, A CORPORATION OF THE STATE OF OHIO (US) 2005-10-13 US claimed
WO-2004004449-A1 USE OF ONE OR MORE CHEMICAL COMPOUND FOR MARKING OF FISH VETERINÆRMEDISINSK OPPDRAGSSENTER AS (NO) 2004-01-15 WO claimed
US-6495302-B1 MIXING LATEX WITH COLORANT; HEATING XEROX CORPORATION 2002-12-17 US claimed
US-20020187416-A1 Toner coagulant processes XEROX CORPORATION 2002-12-12 US claimed
US-20020187415-A1 TONER COAGULANT PROCESSES XEROX CORPORATION 2002-12-12 US claimed
EP-0348509-B1 ANTI-RETROVIRAL DRUG TSUMURA & CO. (JP) 1993-03-24 EP claimed
EP-0348509-A1 ANTI-RETROVIRAL DRUG TSUMURA & CO. (JP) 1990-01-03 EP claimed
US-3957438-A Detecting fluorite in a solid rock sample LOST RIVER MINING CORPORATION LIMITED (CA) 1976-05-18 US claimed