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 | |
|---|---|---|---|---|
| ▸ | OPRM1 known ✓ | P35372 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 2/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.31 |
| ▸ | CCL5 | P13501 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | MC5R | P33032 | 1/20 | 0.31 |
| ▸ | MC1R | Q01726 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 0.31 |
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 SCHEMBL18249628 | 1.00 | CES2 (0.35) | CES2CES1MC4RRIPK1TRPM8 | |
| SCHEMBL18249582 | 0.92 | SLC6A4 (0.32) | CES2CES1MC4RDRD3 | |
| Oxalic Acid SCHEMBL18249573 | 0.90 | CES2 (0.37) | CES2CES1MC4RRIPK1TRPM8 | |
| Oxalic Acid SCHEMBL28496501 | 0.90 | CES2 (0.37) | CES2CES1MC4RRIPK1TRPM8 | |
| Oxalic Acid SCHEMBL28498452 | 0.83 | CCR5 (0.39) | CES2CES1MC4RKDM4EOPRM1 | |
| Oxalic Acid SCHEMBL18249579 | 0.83 | CCR5 (0.39) | CES2CES1MC4RKDM4EOPRM1 | |
| Oxalic Acid SCHEMBL18249620 | 0.82 | CCR5 (0.39) | MC4RKDM4EHTTKDM2BCCL5 | |
| Oxalic Acid SCHEMBL28488476 | 0.82 | CCR5 (0.39) | MC4RKDM4EHTTKDM2BCCL5 | |
| SCHEMBL18249617 | 0.82 | CES2 (0.33) | CES2CES1 | |
| SCHEMBL18249648 | 0.78 | CES2 (0.36) | CES2CES1TRPM8 |
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 |