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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.48 |
| ▸ | YAP1 | P46937 | 1/20 | 0.48 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.48 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.48 |
| ▸ | PLK1 | P53350 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | AHR | P35869 | 2/20 | 0.47 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28131940 | 0.95 | TEAD1 (0.51) | ALDH1A1TEAD1YAP1TEAD4TEAD2 | |
| Sulfuric Acid SCHEMBL28171448 | 0.90 | KMT2A (0.47) | ALDH1A1TEAD1YAP1TEAD4TEAD2 | |
| SCHEMBL28170826 | 0.86 | KMT2A (0.51) | ALDH1A1TEAD1YAP1TEAD4TEAD2 | |
| SCHEMBL28171447 | 0.85 | PLK1 (0.46) | ALDH1A1TEAD1YAP1TEAD4TEAD2 | |
| SCHEMBL2773751 | 0.84 | MCL1 (0.58) | PLK1KDM4EAHRCAPN1MAPT | |
| SCHEMBL28849509 | 0.83 | CYP1A2 (0.42) | ALDH1A1TEAD1YAP1TEAD4TEAD2 | |
| SCHEMBL4093872 | 0.81 | PLK1 (0.52) | ALDH1A1PLK1KDM4EAHRMAPT | |
| SCHEMBL12819707 | 0.80 | TEAD1 (0.51) | ALDH1A1TEAD1YAP1TEAD4TEAD2 | |
| SCHEMBL13348987 | 0.80 | PLK1 (0.51) | ALDH1A1PLK1KDM4EAHRTP53 | |
| SCHEMBL28120127 | 0.80 | PLK1 (0.62) | ALDH1A1TEAD1YAP1TEAD4TEAD2 |
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-107001307-A | Novel salts of 3- [ (dimethylamino) methyl ] -N- {2- [4- (hydroxycarbamoyl) phenoxy ] ethyl } -1-benzofuran-2-carboxamide, related crystalline forms, processes for preparing the same and pharmaceutical compositions comprising the same | 药品循环有限责任公司 | 2017-08-01 | — | — | CN | disclosed |