Edetic Acid

Edetic Acid

SCHEMBL7794247

O.O.O.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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
▸ ACE known ✓ P12821 1/20 0.93
▸ CHRM2 known ✓ P08172 1/20 0.88
▸ ADRA2A known ✓ P08913 1/20 0.88
▸ SLC6A2 known ✓ P23975 1/20 0.88
▸ SLC6A4 known ✓ P31645 1/20 0.88
▸ ADRA1A known ✓ P35348 1/20 0.88
▸ DRD3 known ✓ P35462 1/20 0.88
▸ SLC6A3 known ✓ Q01959 1/20 0.88
▸ TDP1 Q9NUW8 2/20 0.93
▸ EYA2 O00167 1/20 0.93
▸ APP P05067 1/20 0.93
▸ BLM P54132 2/20 0.88
▸ PMP22 Q01453 2/20 0.88
▸ TSHR P16473 2/20 0.88
▸ KDM4E B2RXH2 2/20 0.88
▸ ALOX15 P16050 2/20 0.88
▸ LMNA P02545 1/20 0.88
▸ DRD1 P21728 1/20 0.88
▸ CYP2C19 P33261 1/20 0.88
▸ HRH3 Q9Y5N1 1/20 0.88

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 SCHEMBL731870 1.00 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL11181102 1.00 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL464945 1.00 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL1933603 1.00 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL9640564 1.00 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL23455628 0.97 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL21332394 0.97 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL291274 0.97 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL21436997 0.97 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL20743376 0.97 TDP1 (0.88) TDP1EYA2APPACEBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018130476-A1 METHOD FOR DETERMINING IRON AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2018-07-19 — — WO disclosed
CN-103588572-A Seedling-cultivating nutrient solution for micro agriculture HUZHOU YIMENG CITY AGRICULTURAL DEV CO LTD 2014-02-19 — — CN disclosed
CN-103588587-A Rhizome nutrient solution for micro agriculture HUZHOU YIMENG CITY AGRICULTURAL DEV CO LTD 2014-02-19 — — CN disclosed
EP-0639790-B1 A surface active compound and a silver halide photographic material containing the same FUJI PHOTO FILM CO LTD (JP) 2001-11-21 — — EP disclosed
EP-0567151-B1 Silver halide photographic material FUJI PHOTO FILM CO LTD (JP) 1997-07-02 — — EP disclosed
CN-1025378-C Method of manufacturing silver halide emulsion FUJI PHOTO FILM CO LTD (JP) 1994-07-06 — — CN disclosed
EP-0567151-A1 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1993-10-27 — — EP disclosed
US-5216070-A Using siloxane-emulsifier system for water-in-oil emulsion polymerization ISP INVESTMENTS INC. (US) 1993-06-01 — — US disclosed
CN-1042781-A The method for preparing silver emulsion FUJI PHOTO FILM CO LTD (JP) 1990-06-06 — — CN disclosed
US-4025344-A Lithographic developer replenishment process E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-05-24 — — US disclosed
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