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 | |
|---|---|---|---|---|
| ▸ | OPRM1 known ✓ | P35372 | 2/20 | 0.62 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 20/20 | 0.62 |
| ▸ | ADRA1D | P25100 | 19/20 | 0.62 |
| ▸ | ADRA1B | P35368 | 19/20 | 0.62 |
| ▸ | HTR1A | P08908 | 2/20 | 0.62 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.62 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.62 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.62 |
| ▸ | HRH1 | P35367 | 2/20 | 0.62 |
| ▸ | DRD3 | P35462 | 2/20 | 0.62 |
| ▸ | HTR2B | P41595 | 2/20 | 0.62 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.62 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.62 |
| ▸ | DRD2 | P14416 | 1/20 | 0.62 |
| ▸ | DRD1 | P21728 | 1/20 | 0.62 |
| ▸ | DRD4 | P21917 | 1/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.62 |
| ▸ | HTR1D | P28221 | 1/20 | 0.62 |
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 SCHEMBL526172 | 1.00 | ADRA1A (0.62) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| Oxalic Acid SCHEMBL28644138 | 1.00 | ADRA1A (0.62) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL13729913 | 0.99 | ADRA1A (0.64) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL28926323 | 0.99 | ADRA1A (0.64) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL524564 | 0.99 | ADRA1A (0.64) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL18157802 | 0.95 | ADRA1D (0.62) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| Alpha-Ketoglutaric Acid SCHEMBL17026691 | 0.94 | ADRA1D (0.58) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL28996811 | 0.91 | ADRA1D (0.66) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL13037438 | 0.91 | ADRA1A (0.59) | ADRA1AADRA1DADRA1BHTR1AADRA2A | |
| SCHEMBL19730677 | 0.91 | ADRA1D (0.55) | ADRA1AADRA1DADRA1BHTR1AADRA2A |
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-110452149-B | Preparation method of indoline compound, indoline compound and application | 北京鑫开元医药科技有限公司 | 2021-11-02 | — | — | CN | disclosed |