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Edetic Acid

Edetic Acid

SCHEMBL9067285

O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Fe+3].[Fe+3].[NH4+].[NH4+].[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.70

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
▸ ACE known ✓ P12821 1/20 0.46
▸ CA4 known ✓ P22748 7/20 0.38
▸ CA2 known ✓ P00918 4/20 0.34
▸ CA1 known ✓ P00915 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.70
▸ ALOX15 P16050 2/20 0.70
▸ MAPT P10636 1/20 0.70
▸ SMN1; SMN2 Q16637 1/20 0.70
▸ TDP1 Q9NUW8 2/20 0.46
▸ EYA2 O00167 1/20 0.46
▸ APP P05067 1/20 0.46
▸ BLM P54132 2/20 0.43
▸ PMP22 Q01453 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ ADRA2A P08913 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ SLC6A2 P23975 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43

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 SCHEMBL275773 0.97 KDM4E (0.65) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL7190674 0.97 KDM4E (0.73) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL9847047 0.97 KDM4E (0.65) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL65157 0.97 KDM4E (0.73) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL9564091 0.97 KDM4E (0.73) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL7495735 0.94 KDM4E (0.62) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL6131131 0.94 KDM4E (0.62) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL5273812 0.94 KDM4E (0.70) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL8625956 0.94 KDM4E (0.62) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL8091381 0.94 KDM4E (0.70) KDM4EALOX15MAPTSMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5518870-A Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1996-05-21 — — US disclosed
US-5114837-A Multicolor silver halide emulsion with color sensitizers FUJI PHOTO FILM CO., LTD. (JP) 1992-05-19 — — US disclosed
US-5104781-A Colorfastness, discoloration inhibition FUJI PHOTO FILM CO., LTD. (JP) 1992-04-14 — — US disclosed