Sugi Predict

Sugi Predict / Compounds / Nitrilotriacetic Acid

Nitrilotriacetic Acid

Nitrilotriacetic Acid

SCHEMBL986939

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(CC(=O)O)CC(=O)O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.48
▸ HTT P42858 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ EZH2 Q15910 4/20 0.43
▸ RECQL P46063 1/20 0.42
▸ TSHR P16473 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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 SCHEMBL986441 0.94 GAA (0.46) GAAHTTKDM4EKMT2APOLB
Pentetic Acid SCHEMBL985300 0.93 GAA (0.45) GAAHTTKDM4EKMT2APOLB
SCHEMBL77511 0.85 RECQL (0.55) GAAHTTKDM4EKMT2APOLB
SCHEMBL29453034 0.83 RECQL (0.53) GAAHTTKDM4EKMT2APOLB
Nitrilotriacetic Acid SCHEMBL987466 0.80 GAA (0.42) GAAKDM4EKMT2ATSHRALDH1A1
Nitrilotriacetic Acid SCHEMBL987118 0.80 ALDH1A1 (0.33) GAAKDM4ETSHRALDH1A1ATM
Nitrilotriacetic Acid SCHEMBL986503 0.78 TDP1 (0.37) GAAHTTKDM4EKMT2APOLB
Sulfuric Acid SCHEMBL986271 0.78 RECQL (0.49) GAAHTTKDM4EKMT2APOLB
SCHEMBL6109968 0.76 RECQL (0.46) GAAHTTKMT2APOLBEZH2
Edetic Acid SCHEMBL2831275 0.75 KDM4E (0.40) GAAKDM4EKMT2ATSHR

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