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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 6/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.42 |
| ▸ | NOS2 | P35228 | 6/20 | 0.42 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.35 |
| ▸ | F11 | P03951 | 2/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7648003 | 0.74 | KDM4E (0.42) | CYP2D6SLC6A2SLC6A4NOS2 | |
| Oxalic Acid SCHEMBL6337578 | 0.74 | CYP2D6 (0.53) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 | |
| Oxalic Acid SCHEMBL6490646 | 0.69 | NOS2 (0.74) | CYP2D6SLC6A2SLC6A4NOS2 | |
| SCHEMBL7605985 | 0.67 | SLC6A4 (0.40) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 | |
| SCHEMBL6332207 | 0.67 | NOS2 (0.52) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 | |
| Oxalic Acid SCHEMBL6500140 | 0.66 | NOS2 (0.58) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 | |
| Oxalic Acid SCHEMBL6337687 | 0.65 | NOS2 (0.55) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 | |
| Oxalic Acid SCHEMBL6502548 | 0.64 | SLC6A4 (0.78) | CYP2D6SLC6A2SLC6A4NOS2 | |
| SCHEMBL6328431 | 0.64 | NOS2 (0.49) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 | |
| SCHEMBL6329018 | 0.63 | SLC6A4 (0.70) | CYP2D6SLC6A2SLC6A4NOS2BCL2A1 |
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-1263715-A1 | NOVEL PHENYLHETEROALKYLAMINE DERIVATIVES | AstraZeneca AB (SE) | 2002-12-11 | — | — | EP | disclosed |
| WO-2001062714-A1 | NOVEL PHENYLHETEROALKYLAMINE DERIVATIVES | ASTRAZENECA AB (SE) | 2001-08-30 | — | — | WO | disclosed |