Oxalic Acid

Oxalic Acid

SCHEMBL7978632

C[C@H](Oc1ccc(-c2cccc(CC(=O)N3CCOCC3)c2)cc1)[C@H](O)CCc1cccnc1.O=C(O)C(=O)O

nearest known ligand 0.43

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
MAPT P10636 2/20 0.43
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
PTAFR P25105 1/20 0.39
GRIN2B Q13224 2/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
AOC3 Q16853 3/20 0.37
HTT P42858 1/20 0.37
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
CYP11B2 P19099 2/20 0.36
FAAH O00519 1/20 0.36
NAAA Q02083 1/20 0.36
CYP11B1 P15538 1/20 0.36
GRIN1 Q05586 1/20 0.36

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
SCHEMBL7978633 0.88 MAPT (0.41) MAPTALOX15HSD17B10ALDH1A1KDM4E
SCHEMBL7982543 0.83 ALDH1A1 (0.43) MAPTHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL7982544 0.83 ALDH1A1 (0.43) MAPTHSD17B10ALDH1A1KDM4EHPGD
Oxalic Acid SCHEMBL7980200 0.81 PTAFR (0.45) PTAFRGRIN2BHPGDHTTGRIN1
Oxalic Acid SCHEMBL7966040 0.81 PTAFR (0.45) PTAFRGRIN2BHPGDHTTGRIN1
SCHEMBL7979963 0.80 PTAFR (0.47) PTAFRHPGDHTT
SCHEMBL7979959 0.80 PTAFR (0.47) PTAFRHPGDHTT
SCHEMBL7966272 0.80 PTAFR (0.45) PTAFRHPGDHTT
SCHEMBL7966267 0.80 PTAFR (0.45) PTAFRHPGDHTT
SCHEMBL7982982 0.80 FKBP1A (0.47) ALDH1A1MEN1KMT2ACCNCCDK8

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-6300352-B1 FOR THERAPY OF ASTHMA ASTRAZENECA AB (SE) 2001-10-09 US disclosed