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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL3021120 | 0.94 | GAA (0.48) | GAADGAT1ALDH1A1TSHRFFAR3 | |
| Bicarbonate SCHEMBL28020933 | 0.91 | GAA (0.46) | GAADGAT1ALDH1A1TSHRFFAR3 | |
| Acetic Acid SCHEMBL2928244 | 0.91 | GAA (0.46) | GAADGAT1ALDH1A1TSHRFFAR3 | |
| Acetic Acid SCHEMBL25259384 | 0.91 | GAA (0.46) | GAADGAT1ALDH1A1TSHRFFAR3 | |
| Acetic Acid SCHEMBL28991773 | 0.91 | GAA (0.46) | GAADGAT1ALDH1A1TSHRFFAR3 | |
| SCHEMBL28342310 | 0.91 | GAA (0.50) | GAADGAT1ALDH1A1TSHRTDP1 | |
| SCHEMBL26684 | 0.91 | — | — | |
| SCHEMBL28745990 | 0.91 | GAA (0.50) | GAADGAT1ALDH1A1TSHRTDP1 | |
| SCHEMBL28358909 | 0.91 | GAA (0.50) | GAADGAT1ALDH1A1TSHRTDP1 | |
| Benzene SCHEMBL28127867 | 0.88 | GAA (0.44) | GAADGAT1ALDH1A1TSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0529858-B1 | 2-Piperazinone compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-10-15 | — | — | EP | disclosed |
| EP-0529858-A1 | 2-Piperazinone compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1993-03-03 | — | — | EP | disclosed |