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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | EDNRA | P25101 | 7/20 | 0.39 |
| ▸ | EDNRB | P24530 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 SCHEMBL7996063 | 0.98 | CYP3A4 (0.64) | CYP3A4EDNRAEDNRBDRD2DRD3 | |
| Oxalic Acid SCHEMBL9748438 | 0.97 | CYP3A4 (0.66) | CYP3A4EDNRAEDNRBDRD2DRD3 | |
| Oxalic Acid SCHEMBL9747718 | 0.95 | CYP3A4 (0.63) | CYP3A4EDNRAEDNRBDRD2DRD3 | |
| SCHEMBL7376974 | 0.94 | CYP3A4 (0.65) | CYP3A4EDNRADRD2DRD3MAPK1 | |
| Fumaric Acid SCHEMBL9748067 | 0.94 | CYP3A4 (0.62) | CYP3A4EDNRAEDNRBDRD2DRD3 | |
| Fumaric Acid SCHEMBL9748072 | 0.94 | CYP3A4 (0.62) | CYP3A4EDNRAEDNRBDRD2DRD3 | |
| Semotiadil SCHEMBL80715 | 0.94 | CYP3A4 (0.68) | CYP3A4EDNRADRD2DRD3MAPK1 | |
| Semotiadil SCHEMBL678676 | 0.94 | CYP3A4 (0.68) | CYP3A4EDNRADRD2DRD3MAPK1 | |
| Semotiadil SCHEMBL29396077 | 0.94 | CYP3A4 (0.68) | CYP3A4EDNRADRD2DRD3MAPK1 | |
| Levosemotiadil SCHEMBL678293 | 0.94 | CYP3A4 (0.68) | CYP3A4EDNRADRD2DRD3MAPK1 |
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-0237573-B1 | NOVEL BENZOTHIAZINE DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1992-01-15 | — | — | EP | disclosed |
| US-4786635-A | THERAPEUTIC AGENTS FOR CIRCULATORY DISEASES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1988-11-22 | — | — | US | disclosed |
| EP-0237573-A1 | NOVEL BENZOTHIAZINE DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1987-09-23 | — | — | EP | disclosed |