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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.73 |
| ▸ | AKR1C3 | P42330 | 11/20 | 0.59 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.59 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.59 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | HTR1D | P28221 | 1/20 | 0.53 |
| ▸ | HTR1B | P28222 | 1/20 | 0.53 |
| ▸ | HTR1F | P30939 | 1/20 | 0.53 |
| ▸ | HTR7 | P34969 | 1/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3029516 | 0.86 | HTR6 (0.76) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL3025302 | 0.84 | HTR6 (0.73) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL30485865 | 0.84 | HTR6 (1.00) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL5497004 | 0.84 | HTR6 (1.00) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL13240305 | 0.84 | HTR6 (0.73) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL18133072 | 0.84 | AKR1C3 (0.81) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL1971963 | 0.82 | MTNR1A (0.72) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| Oxalic Acid SCHEMBL27614859 | 0.80 | ADRB2 (0.62) | HTR6AKR1C3AKR1C2ADRB2HTR1A | |
| SCHEMBL7438537 | 0.80 | HTR6 (0.61) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL28924882 | 0.80 | ALOX5 (0.59) | HTR6AKR1C3AKR1C2AKR1C4PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6187805-B1 | TREATING CONDITION FOR WHICH SELECTIVE AGONISM OR ANTAGONISM OF 5-HT-6 RECEPTORS IS INDICATED BY ADMINISTERING COMPOUNDS SUCH AS N,N-DIMETHYL 2-(1-(BENZENESULPHONYL)-5-METHOXY-1H-INDOL-3-YL)ETHYLAMINE | MERCK SHARP & DOHME LTD. (GB) | 2001-02-13 | — | — | US | disclosed |