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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.38 |
| ▸ | NPY1R | P25929 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | F13A1 | P00488 | 1/20 | 0.38 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9811375 | 0.90 | KMT2A (0.46) | KMT2AKDM4ESMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL9811320 | 0.87 | KMT2A (0.41) | KMT2AKDM4ECYP2D6CYP2C19NPC1 | |
| SCHEMBL9811288 | 0.86 | KMT2A (0.44) | KMT2AKDM4ECYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL9811304 | 0.85 | KMT2A (0.43) | KMT2AKDM4ESMN1; SMN2MEN1NPY5R | |
| Hydrochloric Acid SCHEMBL9620334 | 0.83 | PKM (0.54) | KMT2AKDM4ECYP2C19ALDH1A1MEN1 | |
| SCHEMBL9811328 | 0.83 | KMT2A (0.43) | KMT2AKDM4ECYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL9620583 | 0.79 | ALDH1A1 (0.57) | KMT2AKDM4ECYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL9620317 | 0.77 | PKM (0.56) | KMT2AKDM4ECYP2C19SMN1; SMN2ALDH1A1 | |
| SCHEMBL10656976 | 0.77 | ALDH1A1 (0.48) | KMT2AALDH1A1MEN1NPY5RLMNA | |
| SCHEMBL9811280 | 0.75 | ALDH1A1 (0.39) | KMT2AKDM4ESMN1; SMN2ALDH1A1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0223124-B1 | SUBSTITUTED AMINOSULFONYL 6-NITROBENZOIC-ESTERS OR AMIDES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |
| US-4731369-A | Amides and esters of 2-(N-(hydroxypiperidinoalkyl) and (hydroxypyrrolidinoalkyl)-aminosulfonyl)-6-nitrobenzoic acids useful as adjuncts to radiation therapy | MERCK & CO. INC. (US) | 1988-03-15 | — | — | US | disclosed |
| EP-0223124-A1 | Substituted aminosulfonyl 6-nitrobenzoic-esters or amides, processes for their preparation and pharmaceutical compositions containing them | MERCK & CO. INC. (US) | 1987-05-27 | — | — | EP | disclosed |