Nitrilotriacetic Acid

Nitrilotriacetic Acid

SCHEMBL11684108

O=C([O-])CN(CC(=O)[O-])CC(=O)[O-].[Cr+3]

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
ALOX15 P16050 2/20 0.52
MAPT P10636 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CA4 P22748 3/20 0.41
CASP1 P29466 1/20 0.37
FFAR3 O14843 2/20 0.33
HDAC3 O15379 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
EYA2 O00167 1/20 0.33
APP P05067 1/20 0.33
ACE P12821 1/20 0.33
LMNA P02545 1/20 0.32
CHRM2 P08172 1/20 0.32
ADRA2A P08913 1/20 0.32
TSHR P16473 1/20 0.32
DRD1 P21728 1/20 0.32

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
Nitrilotriacetic Acid SCHEMBL10664583 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL2810628 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL1535541 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL43736 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL7458702 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL23358712 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL3482707 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL1284701 0.93 KDM4E (0.59) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL1684921 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4
Nitrilotriacetic Acid SCHEMBL11309540 0.93 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2CA4

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
CN-110748331-A Non-flowback fracturing-oil displacement integrated oilfield production increasing method 西安石油大学 2020-02-04 CN claimed
CN-110748331-A Non-flowback fracturing-oil displacement integrated oilfield production increasing method 西安石油大学 2020-02-04 CN disclosed
US-4016129-A AQUEOUS DISPERSION OF A SILICA-POLYVINYL ALCOHOL COMPLEX KANSAI PAINT COMPANY, LTD. (JA) 1977-04-05 US disclosed