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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.54 |
| ▸ | HTR4 | Q13639 | 11/20 | 0.60 |
| ▸ | HTR3A | P46098 | 4/20 | 0.60 |
| ▸ | HTR2C | P28335 | 4/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.60 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.60 |
| ▸ | HTR3B | O95264 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.60 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.60 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.59 |
| ▸ | HTR1D | P28221 | 4/20 | 0.59 |
| ▸ | HTR2B | P41595 | 4/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.59 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.59 |
| ▸ | HTR2A | P28223 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL7401197 | 0.97 | HTR4 (0.62) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| Oxalic Acid SCHEMBL7450585 | 0.92 | HTR4 (0.59) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| Oxalic Acid SCHEMBL7401433 | 0.91 | HTR4 (0.58) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| SCHEMBL7393158 | 0.89 | HTR4 (0.61) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| SCHEMBL7400568 | 0.88 | HTR4 (0.61) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| SCHEMBL7399116 | 0.88 | HTR4 (0.58) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| SCHEMBL9278210 | 0.85 | HTR4 (0.49) | HTR4HTR3AHTR2CCYP2D6CYP2C9 | |
| SCHEMBL6328102 | 0.82 | HTR4 (0.70) | HTR4CYP2D6CYP2C9CYP3A4MEN1 | |
| SCHEMBL6333842 | 0.81 | HTR4 (0.58) | HTR4CYP2D6CYP2C9MEN1ALDH1A1 | |
| SCHEMBL13439990 | 0.77 | HTR4 (0.76) | HTR4HTR3AHTR2CCYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5696129-A | TREATING GASTROINTESTINAL DISORDERS | SMITHKLINE BEECHAM P.L.C. (GB) | 1997-12-09 | — | — | US | disclosed |
| EP-0662959-A1 | 5-HT4 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-07-19 | — | — | EP | disclosed |
| WO-1994007859-A1 | 5-HT4 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-04-14 | — | — | WO | disclosed |