Known targets — ChEMBL curated mechanism
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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ARG1 | P05089 | 2/20 | 0.44 |
| ▸ | ARG2 | P78540 | 2/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2297876 | 0.90 | KEAP1 (0.50) | ARG1ARG2KEAP1SMN1; SMN2DPP7 | |
| Oxalic Acid SCHEMBL9345814 | 0.89 | ALOX15 (0.46) | ARG1ARG2DPP7CHRM3KCNA3 | |
| SCHEMBL26493965 | 0.84 | KEAP1 (0.43) | ARG1ARG2KEAP1SMN1; SMN2DPP7 | |
| SCHEMBL26493993 | 0.82 | SLC6A4 (0.46) | KEAP1SMN1; SMN2DPP7KCNA3SIGMAR1 | |
| SCHEMBL26494009 | 0.82 | SLC6A4 (0.46) | KEAP1SMN1; SMN2DPP7KCNA3SIGMAR1 | |
| Oxalic Acid SCHEMBL9344962 | 0.82 | CHRM3 (0.41) | ARG1ARG2KEAP1SMN1; SMN2CHRM3 | |
| SCHEMBL2674136 | 0.79 | PDCD1 (0.44) | KEAP1SMN1; SMN2DPP7KCNA3 | |
| SCHEMBL12280022 | 0.79 | PDCD1 (0.44) | KEAP1SMN1; SMN2DPP7KCNA3 | |
| SCHEMBL12279922 | 0.79 | PDCD1 (0.44) | KEAP1SMN1; SMN2DPP7KCNA3 | |
| SCHEMBL722623 | 0.78 | ALOX15 (0.57) | ARG1ARG2KCNA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5280031-A | Cyclic azaaliphatic compounds with a nitroxy function, processes for the preparation thereof and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-01-18 | — | — | US | disclosed |
| US-5030641-A | Treatment of angina pectoris, hypotensive agents | BOEHRINGER MANNHEIM GMBH (DE) | 1991-07-09 | — | — | US | disclosed |