Oxalic Acid

Oxalic Acid

SCHEMBL9049191

Clc1ccc2[nH]cc(C3CCN(CCCc4cn[nH]c4)CC3)c2c1.O=C(O)C(=O)O

nearest known ligand 0.56

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 10)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 1/20 0.56
OPRK1 P41145 1/20 0.56
OPRL1 P41146 1/20 0.56
HTR6 P50406 1/20 0.47
KCNH2 Q12809 1/20 0.47
HTR1D P28221 9/20 0.46
HTR1B P28222 7/20 0.45
CHRM2 P08172 1/20 0.45
DRD2 P14416 1/20 0.45
CCR2 P41597 4/20 0.44

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
SCHEMBL7460623 0.94 OPRM1 (0.60) OPRM1OPRK1OPRL1HTR6KCNH2
SCHEMBL5385661 0.81 OPRM1 (0.64) OPRM1OPRK1OPRL1HTR1DHTR1B
Oxalic Acid SCHEMBL9046271 0.78 OPRM1 (0.53) OPRM1OPRK1OPRL1HTR6KCNH2
Oxalic Acid SCHEMBL9048518 0.78 OPRM1 (0.58) OPRM1OPRK1OPRL1HTR6KCNH2
Oxalic Acid SCHEMBL9049148 0.77 OPRM1 (0.55) OPRM1OPRK1OPRL1HTR6KCNH2
Hydrochloric Acid SCHEMBL9048212 0.76 OPRM1 (0.57) OPRM1OPRK1OPRL1HTR6HTR1D
SCHEMBL8876513 0.76 OPRM1 (0.66) OPRM1OPRK1OPRL1HTR1DHTR1B
Oxalic Acid SCHEMBL9048940 0.76 OPRM1 (0.51) OPRM1OPRK1OPRL1HTR1DHTR1B
Oxalic Acid SCHEMBL9048237 0.76 OPRM1 (0.55) OPRM1OPRK1OPRL1HTR6KCNH2
Oxalic Acid SCHEMBL9045773 0.76 OPRM1 (0.51) OPRM1OPRK1OPRL1HTR6KCNH2

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
EP-0708102-A1 5-HT1F agonists for the treatment of migraine ELI LILLY AND COMPANY (US) 1996-04-24 EP disclosed