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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT2 | O60551 | 1/20 | 0.45 |
| ▸ | NMT1 | P30419 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 7/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9202875 | 0.96 | NMT2 (0.44) | NMT2NMT1SIGMAR1HRH1DRD2 | |
| Oxalic Acid SCHEMBL9274045 | 0.90 | SIGMAR1 (0.46) | NMT2NMT1SIGMAR1HRH1DRD2 | |
| Oxalic Acid SCHEMBL9201124 | 0.83 | SIGMAR1 (0.64) | SIGMAR1ALDH1A1MEN1KMT2A | |
| Oxalic Acid SCHEMBL9277534 | 0.83 | NMT2 (0.50) | NMT2NMT1SIGMAR1HRH1DRD3 | |
| SCHEMBL9205713 | 0.82 | HTR1A (0.42) | NMT2NMT1HRH1DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL9206504 | 0.81 | HTR1A (0.42) | NMT2NMT1HRH1DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL9203230 | 0.81 | SIGMAR1 (0.47) | NMT2NMT1SIGMAR1DRD2DRD3 | |
| Oxalic Acid SCHEMBL9430076 | 0.79 | ALDH1A1 (0.49) | HRH1DRD2DRD3ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL9283992 | 0.79 | BCHE (0.45) | SIGMAR1ALDH1A1KDM4EHTR1AMEN1 | |
| Hydrochloric Acid SCHEMBL9201224 | 0.78 | SIGMAR1 (0.46) | SIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0430693-B1 | Pyrimidinedione derivative compounds, method for preparing same, and antiarrhythmic agents containing same | MITSUI TOATSU CHEMICALS (JP) | 1995-05-31 | — | — | EP | disclosed |
| US-5114941-A | PYRIMIDINEDIONE DERIVATIVE COMPOUNDS, METHOD FOR PREPARING SAME, AND ANTIARRYTHMIC AGENTS CONTAINING SAME | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1992-05-19 | — | — | US | disclosed |
| EP-0430693-A2 | Pyrimidinedione derivative compounds, method for preparing same, and antiarrhythmic agents containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-06-05 | — | — | EP | disclosed |