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 | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.59 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.56 |
| ▸ | PPARG | P37231 | 7/20 | 0.56 |
| ▸ | PPARD | Q03181 | 7/20 | 0.56 |
| ▸ | PPARA | Q07869 | 7/20 | 0.56 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.56 |
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | TLR2 | O60603 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | FABP4 | P15090 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.56 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | PDE4A | P27815 | 1/20 | 0.56 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.56 |
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 SCHEMBL28884528 | 0.97 | GPR84 (0.61) | AKR1B1GPR84PPARGPPARDPPARA | |
| Acetic Acid SCHEMBL5305838 | 0.92 | AKR1B1 (0.62) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hydrogen Peroxide SCHEMBL2361360 | 0.92 | GPR84 (0.67) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL29364 | 0.92 | — | — | |
| SCHEMBL1324565 | 0.92 | CES2 (0.63) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL1580170 | 0.92 | — | — | |
| 2-Nonanone SCHEMBL8213625 | 0.90 | GPR84 (0.64) | AKR1B1GPR84PPARGPPARDPPARA | |
| 2-Tridecanone SCHEMBL8658406 | 0.90 | GPR84 (0.64) | AKR1B1GPR84PPARGPPARDPPARA | |
| Methyl Nonyl Ketone SCHEMBL10344896 | 0.90 | GPR84 (0.64) | AKR1B1GPR84PPARGPPARDPPARA | |
| Acetic Acid SCHEMBL28957708 | 0.90 | GPR84 (0.64) | AKR1B1GPR84PPARGPPARDPPARA |
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-104151321-B | N-(2-chloro-6-aminomethyl phenyl)-2 [(2-methylpyrimidine-4-base) amino] thiazole-5-methanamide compound and its production and use | 复旦大学 | 2016-09-07 | — | — | CN | disclosed |