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Sugi Predict / Compounds / Edetic Acid

Edetic Acid

Edetic Acid

SCHEMBL986441

CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.46
▸ HTT P42858 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.41
▸ EYA2 O00167 1/20 0.41
▸ APP P05067 1/20 0.41
▸ ACE P12821 1/20 0.41
▸ EZH2 Q15910 3/20 0.41
▸ RECQL P46063 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40

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
Pentetic Acid SCHEMBL985300 0.99 GAA (0.45) GAAHTTKDM4EKMT2APOLB
Nitrilotriacetic Acid SCHEMBL986939 0.94 GAA (0.48) GAAHTTKDM4EKMT2APOLB
SCHEMBL77511 0.82 RECQL (0.55) GAAHTTKDM4EKMT2APOLB
Edetic Acid SCHEMBL986797 0.81 TDP1 (0.40) KDM4ETDP1EYA2APPACE
Edetic Acid SCHEMBL1233036 0.81 KDM4E (0.40) GAAKDM4EKMT2ATDP1EYA2
Edetic Acid SCHEMBL1232066 0.81 KDM4E (0.40) GAAKDM4EKMT2ATDP1EYA2
Edetic Acid SCHEMBL2831275 0.81 KDM4E (0.40) GAAKDM4EKMT2ATDP1EYA2
Edetic Acid SCHEMBL986952 0.81 KDM4E (0.40) GAAKDM4EKMT2ATDP1EYA2
Edetic Acid SCHEMBL15163476 0.81 KDM4E (0.40) GAAKDM4EKMT2ATDP1EYA2
SCHEMBL29453034 0.81 RECQL (0.53) GAAHTTKDM4EKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 — — US claimed
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 — — WO claimed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 — — US claimed
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 — — US disclosed
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 — — WO disclosed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 — — US disclosed