Edetic Acid

Edetic Acid

SCHEMBL8680490

O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O.[Co].[Cu].[Cu]

nearest known ligand 0.88

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.88
EYA2 O00167 1/20 0.88
APP P05067 1/20 0.88
ACE P12821 1/20 0.88
BLM P54132 2/20 0.82
PMP22 Q01453 2/20 0.82
KDM4E B2RXH2 2/20 0.82
ALOX15 P16050 2/20 0.82
TSHR P16473 2/20 0.82
LMNA P02545 1/20 0.82
CHRM2 P08172 1/20 0.82
ADRA2A P08913 1/20 0.82
DRD1 P21728 1/20 0.82
SLC6A2 P23975 1/20 0.82
SLC6A4 P31645 1/20 0.82
CYP2C19 P33261 1/20 0.82
ADRA1A P35348 1/20 0.82
DRD3 P35462 1/20 0.82
SLC6A3 Q01959 1/20 0.82
HRH3 Q9Y5N1 1/20 0.82

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 SCHEMBL8680482 1.00 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL144662 0.97 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL193505 0.97 TDP1 (0.93) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL8380820 0.94 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL21483277 0.94 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL8380881 0.94 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL3857252 0.94 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL413599 0.94 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL7209772 0.94 TDP1 (0.88) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL243997 0.94 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998018463-A1 ANTHELMINTIC FORMULATION CHEMVET (NZ) LIMITED (NZ) 1998-05-07 WO disclosed