Oxalic Acid

Oxalic Acid

SCHEMBL28200760

BrNNc1cc(Br)cc(Br)c1.O=C(O)C(=O)O

nearest known ligand 0.39

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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
ACP1 P24666 1/20 0.39
GPR35 Q9HC97 1/20 0.37
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
GFER P55789 1/20 0.33
AKR1C4 P17516 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32
MAPK14 Q16539 2/20 0.32
HSPD1 P10809 1/20 0.32
HSPE1 P61604 1/20 0.32
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
GAA P10253 1/20 0.31
TGM2 P21980 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL28200762 0.86 ACP1 (0.33) ACP1
Hydrochloric Acid SCHEMBL28200855 0.84 IDO1 (0.36) ACP1
Phosphoric Acid SCHEMBL28856228 0.83 MMP2 (0.38) ACP1
Sulfuric Acid SCHEMBL28200853 0.83 ACP1 (0.47) ACP1
Oxalic Acid SCHEMBL28200798 0.81 MEN1 (0.39) MEN1KMT2AALDH1A1MAPTMAPK1
Oxalic Acid SCHEMBL28200756 0.80 GAA (0.49) MEN1KMT2AALDH1A1MAPTMAOA
Oxalic Acid SCHEMBL28200201 0.78 SMN1; SMN2 (0.48) MEN1KMT2AALDH1A1MAPTGFER
Oxalic Acid SCHEMBL28200725 0.74 MAPT (0.40) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL8794958 0.72 ACP1 (0.37) ACP1ALDH1A1
Oxalic Acid SCHEMBL28200133 0.72 GPR35 (0.41) GPR35AKR1C4AKR1C3AKR1C2AKR1C1

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
CN-107663161-A A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt 上海惠和化德生物科技有限公司 2018-02-06 CN disclosed