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 | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | ADAM17 | P78536 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28872246 | 0.72 | NPC1 (0.64) | RAB9ANPC1SMN1; SMN2ADAM17HPGD | |
| SCHEMBL2731878 | 0.72 | NPC1 (0.68) | RAB9ANPC1SMN1; SMN2ADAM17CYP2C19 | |
| SCHEMBL6517039 | 0.72 | POLB (0.46) | RAB9ANPC1SMN1; SMN2CYP2C19HPGD | |
| SCHEMBL11261156 | 0.71 | NPC1 (0.52) | ADORA2ARAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL6226976 | 0.70 | L3MBTL1 (0.52) | ADORA2ARAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL3907865 | 0.70 | RAB9A (0.53) | RAB9ANPC1SMN1; SMN2CYP2C19HPGD | |
| SCHEMBL30016228 | 0.69 | NPC1 (0.55) | RAB9ANPC1SMN1; SMN2ADAM17CYP2C19 | |
| Oxalic Acid SCHEMBL11112449 | 0.69 | TDP1 (0.44) | SMN1; SMN2HPGDLMNAALDH1A1POLB | |
| SCHEMBL3685770 | 0.68 | CYP2C19 (0.43) | RAB9ANPC1SMN1; SMN2CYP2C19ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11086564 | 0.68 | CYP2C19 (0.43) | RAB9ANPC1SMN1; SMN2CYP2C19ALDH1A1 |
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-4487931-A | Process for the preparation of 2-(thien-2-yl)- and 2-(thien-3-yl)-ethylamine derivatives | SANOFI (FR) | 1984-12-11 | — | — | US | disclosed |
| US-4482718-A | Process for the preparation of 2-(thien-2-yl)- and 2-(thien-3-yl)-ethylamine derivatives | SANOFI (FR) | 1984-11-13 | — | — | US | disclosed |