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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 8/20 | 0.48 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.48 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.41 |
| ▸ | NOX1 | Q9Y5S8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5080333 | 0.94 | CACNA2D1 (0.57) | CACNA2D1SLC6A2SLC6A4HTR1B | |
| Iodide SCHEMBL2607 | 0.92 | CACNA2D1 (0.56) | CACNA2D1SLC6A2SLC6A4HTR1B | |
| Oxalic Acid SCHEMBL3770 | 0.85 | SLC6A4 (0.69) | CACNA2D1SLC6A2SLC6A4 | |
| SCHEMBL9995405 | 0.83 | SLC6A4 (0.67) | CACNA2D1SLC6A2SLC6A4UTS2RHTR1B | |
| Bromide SCHEMBL6726247 | 0.82 | SLC6A4 (0.65) | CACNA2D1SLC6A2SLC6A4UTS2RHTR1B | |
| Maleic Acid SCHEMBL7311827 | 0.81 | SLC6A2 (0.56) | SLC6A2SLC6A4UTS2RKDM4EALDH1A1 | |
| Oxalic Acid SCHEMBL3562 | 0.80 | SLC6A2 (0.63) | CACNA2D1SLC6A2SLC6A4UTS2RKDM4E | |
| Oxalic Acid SCHEMBL4145 | 0.78 | SLC6A2 (0.64) | CACNA2D1SLC6A2SLC6A4UTS2RKDM4E | |
| SCHEMBL3522 | 0.78 | MAPK1 (0.41) | CACNA2D1SLC6A2SLC6A4KDM4EALDH1A1 | |
| Oxalic Acid SCHEMBL3923 | 0.78 | SLC6A4 (0.61) | CACNA2D1SLC6A2SLC6A4UTS2RKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5023269-A | 3-aryloxy-3-substituted propanamines | ELI LILLY AND COMPANY (US) | 1991-06-11 | — | — | US | disclosed |
| EP-0273658-B1 | 3-ARYLOXY-3-SUBSTITUTED PROPANAMINES | ELI LILLY AND COMPANY (US) | 1990-10-31 | — | — | EP | disclosed |
| US-4956388-A | ANTIDEPRESSANTS, ANTIANXIETY, TREATMENT OF OBESITY, ADDICTION TO SMOKING AND ALCOHOL | ELI LILLY AND COMPANY (US) | 1990-09-11 | — | — | US | disclosed |
| EP-0273658-A1 | 3-Aryloxy-3-substituted propanamines | ELI LILLY AND COMPANY (US) | 1988-07-06 | — | — | EP | disclosed |