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 | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 7/20 | 0.39 |
| ▸ | CCL5 | P13501 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 SCHEMBL18249620 | 1.00 | CCR5 (0.39) | CCR5CCL5CYP2D6KCNH2KDM4E | |
| SCHEMBL18249640 | 0.92 | CCL5 (0.36) | CCR5CCL5 | |
| Oxalic Acid SCHEMBL18249652 | 0.89 | CCR5 (0.36) | CCR5CCL5CYP2D6KCNH2CACNA2D1 | |
| Oxalic Acid SCHEMBL28498459 | 0.82 | CES2 (0.35) | CCR5CCL5KDM4EHTTKDM2B | |
| Oxalic Acid SCHEMBL18249628 | 0.82 | CES2 (0.35) | CCR5CCL5KDM4EHTTKDM2B | |
| SCHEMBL18249608 | 0.79 | CCL5 (0.33) | CCR5CCL5KDM4E | |
| SCHEMBL18249653 | 0.79 | DRD3 (0.33) | CCR5 | |
| Oxalic Acid SCHEMBL20164088 | 0.77 | CCR5 (0.34) | CCR5CYP2D6KDM4ECYP3A4 | |
| Oxalic Acid SCHEMBL28501234 | 0.77 | CCR5 (0.34) | CCR5CYP2D6KDM4ECYP3A4 | |
| SCHEMBL19734482 | 0.76 | CCL5 (0.31) | CCR5CCL5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107646031-B | Azetidine derivatives as modulators of cortical catecholaminergic neurotransmission | 综合研究实验室瑞典股份公司 | 2020-11-17 | — | — | CN | disclosed |