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 | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 SCHEMBL2779906 | 1.00 | PTGS2 (0.51) | PTGS2KDM4EALDH1A1SMN1; SMN2NPC1 | |
| Oxalic Acid SCHEMBL2780299 | 0.94 | PTGS2 (0.51) | PTGS2KDM4EALDH1A1SMN1; SMN2NPC1 | |
| Oxalic Acid SCHEMBL2780296 | 0.94 | PTGS2 (0.51) | PTGS2KDM4EALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL13086302 | 0.86 | ALDH1A1 (0.42) | PTGS2KDM4EALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL13086323 | 0.86 | ALDH1A1 (0.41) | PTGS2KDM4EALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL13086654 | 0.80 | KCNJ1 (0.44) | KDM4EALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL13086580 | 0.79 | ALDH1A1 (0.41) | PTGS2KDM4EALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL2777155 | 0.79 | KCNJ1 (0.44) | KDM4EALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3031438 | 0.76 | PTGS2 (0.69) | PTGS2KDM4EALDH1A1RAB9ATDP1 | |
| Hydrochloric Acid SCHEMBL2821285 | 0.76 | PTGS2 (0.58) | PTGS2KDM4EALDH1A1SMN1; SMN2CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010118968-A1 | NO-DONOR ASPIRIN DERIVATIVES | NICOX S.A. (FR) | 2010-10-21 | — | — | WO | disclosed |