Edetic Acid

Edetic Acid

SCHEMBL4806311

Cc1ccccc1.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.58

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.58
EYA2 O00167 1/20 0.58
APP P05067 1/20 0.58
ACE P12821 1/20 0.58
TSHR P16473 3/20 0.56
LMNA P02545 2/20 0.56
BLM P54132 2/20 0.56
PMP22 Q01453 2/20 0.56
ALOX15 P16050 2/20 0.56
CYP2C19 P33261 2/20 0.56
KDM4E B2RXH2 1/20 0.56
CHRM2 P08172 1/20 0.56
ADRA2A P08913 1/20 0.56
DRD1 P21728 1/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A4 P31645 1/20 0.56
ADRA1A P35348 1/20 0.56
DRD3 P35462 1/20 0.56
SLC6A3 Q01959 1/20 0.56
HRH3 Q9Y5N1 1/20 0.56

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 SCHEMBL17984124 0.81 TDP1 (0.61) TDP1EYA2APPACETSHR
Edetic Acid SCHEMBL17183002 0.79 ALDH1A1 (0.58) TDP1EYA2APPACETSHR
Toluene SCHEMBL7854301 0.78 TSHR (0.55) TDP1TSHRLMNAALOX12ACHE
SCHEMBL2807141 0.78 TDP1 (0.56) TDP1EYA2APPACETSHR
Pentetic Acid SCHEMBL10361749 0.78 TDP1 (0.60) TDP1EYA2APPACETSHR
SCHEMBL2284795 0.78 TDP1 (0.56) TDP1EYA2APPACETSHR
SCHEMBL12243695 0.78 TDP1 (0.56) TDP1EYA2APPACETSHR
SCHEMBL12243645 0.78 TDP1 (0.56) TDP1EYA2APPACETSHR
Edetic Acid SCHEMBL3810357 0.77 TDP1 (0.88) TDP1EYA2APPACETSHR
Edetic Acid SCHEMBL9128547 0.77 TDP1 (0.88) TDP1EYA2APPACETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371360-B2 Phyllosilicate is subjected to ion exchange with cationic surfactant and, organic intercalate compound is intercalated in phyllosilicate, with the proviso that intercalation of dimethylformamide, chloroform, dimethylacetamide, toluene and dimethylsulfoxide can take place also without prior ion exchange HILTI AKTIENGESELLSCHAFT (LI) 2008-05-13 US claimed
US-20040183051-A1 Method for producing phyllosilicate-intercalation compounds, the intercalation compounds thereby obtained and their use HILTI AKTIENGESELLSCHAFT (LI) 2004-09-23 US claimed