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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8711162 | 0.98 | CYP2D6 (0.50) | CYP2D6CYP2C19SMN1; SMN2HTR2AKDM4E | |
| Oxalic Acid SCHEMBL9229973 | 0.92 | CYP2D6 (0.49) | CYP2D6CYP2C19SMN1; SMN2HTR2AKDM4E | |
| Oxalic Acid SCHEMBL8711416 | 0.92 | CYP2D6 (0.46) | CYP2D6CYP2C19SMN1; SMN2HTR2AKDM4E | |
| Oxalic Acid SCHEMBL8716566 | 0.91 | CYP2D6 (0.46) | CYP2D6CYP2C19SMN1; SMN2HTR2AKDM4E | |
| SCHEMBL9228248 | 0.90 | CYP2D6 (0.51) | CYP2D6CYP2C19HTR2AKDM4ECYP1A2 | |
| Oxalic Acid SCHEMBL9231556 | 0.90 | HTR2A (0.49) | CYP2D6CYP2C19HTR2AKDM4ECYP1A2 | |
| Oxalic Acid SCHEMBL9233325 | 0.89 | CYP2D6 (0.47) | CYP2D6CYP2C19HTR2AKDM4ECYP1A2 | |
| SCHEMBL8716680 | 0.89 | CYP2D6 (0.48) | CYP2D6CYP2C19SMN1; SMN2HTR2AKDM4E | |
| Oxalic Acid SCHEMBL8711790 | 0.89 | CYP2C19 (0.51) | CYP2D6CYP2C19SMN1; SMN2HTR2AKDM4E | |
| Oxalic Acid SCHEMBL9231541 | 0.89 | CYP2D6 (0.49) | CYP2D6CYP2C19HTR2AKDM4ECYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5728835-A | HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS | TOA EIYO, LTD. (JP) | 1998-03-17 | — | — | US | disclosed |
| EP-0661266-A1 | Substituted cyclic amine compounds as 5HT2 antagonists | TOA EIYO LTD. (JP) | 1995-07-05 | — | — | EP | disclosed |