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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 13/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL9524290 | 0.88 | CYP19A1 (0.47) | CYP19A1TBXAS1CYP11B1ALDH1A1HPGD | |
| Oxalic Acid SCHEMBL9867754 | 0.86 | CYP19A1 (0.46) | CYP19A1TBXAS1CYP11B1ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL9523958 | 0.85 | CYP19A1 (0.48) | CYP19A1TBXAS1CYP11B1ALDH1A1HPGD | |
| SCHEMBL2352227 | 0.80 | CYP19A1 (0.58) | CYP19A1TBXAS1CYP11B1ALDH1A1HPGD | |
| SCHEMBL9523312 | 0.77 | CYP19A1 (0.65) | CYP19A1CYP11B1 | |
| Oxalic Acid SCHEMBL9868434 | 0.76 | CYP19A1 (0.48) | CYP19A1TBXAS1ALDH1A1HPGDCYP17A1 | |
| Oxalic Acid SCHEMBL27268074 | 0.76 | CYP19A1 (0.48) | CYP19A1TBXAS1ALDH1A1HPGDCYP17A1 | |
| SCHEMBL31132754 | 0.75 | PDE2A (0.50) | NPC1LMNARAB9AALDH1A1HPGD | |
| Oxalic Acid SCHEMBL9527036 | 0.75 | CYP19A1 (0.51) | CYP19A1TBXAS1CYP11B1ALDH1A1HPGD | |
| Oxalic Acid SCHEMBL27275153 | 0.75 | CYP19A1 (0.51) | CYP19A1TBXAS1CYP11B1ALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5039677-A | Estrogen inhibitor | JANSSEN PHARMACEUTICA N.V. (CA) | 1991-08-13 | — | — | US | disclosed |
| US-4943574-A | AROMATASE INHIBITORS, ESTROGEN DISORDERS | JANSSEN PHARMACEUTICA N.V. (BE) | 1990-07-24 | — | — | US | disclosed |