Oxalic Acid

Oxalic Acid

SCHEMBL9795343

CN(C)CC(=O)NCCO.O=C(O)C(=O)O

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Oxalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.37
ALDH1A1 P00352 4/20 0.36
CNR1 P21554 3/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
GAA P10253 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
KDM4E B2RXH2 2/20 0.33
SELP P16109 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
FAAH O00519 1/20 0.33
KCNK3 O14649 1/20 0.33
CNR2 P34972 1/20 0.33
BLM P54132 1/20 0.33
TRPV1 Q8NER1 1/20 0.33

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
SCHEMBL1569983 0.94 DNM1 (0.40) DNM1ALDH1A1CNR1MEN1KMT2A
Hydrochloric Acid SCHEMBL7583332 0.91 DNM1 (0.39) DNM1ALDH1A1CNR1MEN1KMT2A
SCHEMBL4578889 0.81 DNM1 (0.46) DNM1ALDH1A1CNR1MEN1KMT2A
SCHEMBL12565683 0.80 MEN1 (0.39) DNM1ALDH1A1CNR1MEN1KMT2A
SCHEMBL22382538 0.78 DNM1 (0.36) DNM1ALDH1A1MEN1KMT2AUSP2
SCHEMBL1827225 0.78 MEN1 (0.54) DNM1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL8741153 0.78 MEN1 (0.48) DNM1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL20710636 0.77 DNM1 (0.59) DNM1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL20411687 0.77 ECE1 (0.52) DNM1CNR1KDM4EFAAHCNR2
SCHEMBL20414885 0.77 ECE1 (0.52) DNM1CNR1KDM4EFAAHCNR2

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
US-5037849-A For treatment of heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1991-08-06 US disclosed