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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 12/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL21436242 | 1.00 | AR (0.36) | ARTRPA1CYP2D6CYP2C9TACR1 | |
| SCHEMBL21452006 | 0.96 | AR (0.39) | ARTRPA1CYP2D6CYP2C9TACR1 | |
| SCHEMBL21436244 | 0.82 | AR (0.34) | ARTRPA1CYP2D6CYP2C9TACR1 | |
| SCHEMBL30829164 | 0.79 | PDE2A (0.40) | — | |
| SCHEMBL21436149 | 0.79 | PDE2A (0.40) | — | |
| Oxalic Acid SCHEMBL21436257 | 0.79 | SLC6A3 (0.38) | — | |
| Oxalic Acid SCHEMBL21436151 | 0.79 | NPC1 (0.35) | TRPA1KCNH2 | |
| SCHEMBL23490811 | 0.79 | AR (0.32) | ARTRPA1CYP2D6CYP2C9TACR1 | |
| Hydrochloric Acid SCHEMBL28903253 | 0.78 | PDE2A (0.39) | — | |
| SCHEMBL21452004 | 0.75 | SLC22A12 (0.38) | ARTRPA1CYP2D6CYP2C9TACR1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111936476-B | Aromatic compound and preparation method and application thereof | 上海致根医药科技有限公司 | 2024-04-02 | — | — | CN | disclosed |