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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 20/20 | 0.80 |
| ▸ | HDAC2 | Q92769 | 15/20 | 0.80 |
| ▸ | HDAC3 | O15379 | 15/20 | 0.80 |
| ▸ | NCOR2 | Q9Y618 | 11/20 | 0.80 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.80 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.80 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.80 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.80 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.80 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.80 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.80 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.80 |
| ▸ | TET3 | O43151 | 1/20 | 0.80 |
| ▸ | BRD4 | O60885 | 1/20 | 0.80 |
| ▸ | FOXO1 | Q12778 | 1/20 | 0.80 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.80 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.80 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL4349158 | 0.98 | HDAC1 (0.83) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL30255503 | 0.98 | HDAC1 (0.83) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL4349156 | 0.98 | HDAC1 (0.83) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL31087946 | 0.98 | HDAC1 (0.83) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| Hydrochloric Acid SCHEMBL19743942 | 0.97 | HDAC1 (0.81) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| Bromide SCHEMBL20165852 | 0.97 | HDAC1 (0.81) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| Oxalic Acid SCHEMBL20165845 | 0.91 | HDAC1 (0.75) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL4380126 | 0.89 | HDAC1 (1.00) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| Panobinostat SCHEMBL22773814 | 0.89 | HDAC1 (1.00) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| Panobinostat SCHEMBL164801 | 0.89 | HDAC1 (1.00) | HDAC1HDAC2HDAC3NCOR2HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018092151-A1 | PROCESS FOR THE PREPARATION OF 2-(E)-N-HYDROXY-3-[4-[[[2-(2-METHYL-1H-INDOL-3-YL) ETHYL]AMINO]METHYL]PHENYL]-2-PROPENAMIDE 2-HYDROXYPROPANOIC ACID (1:1) AND ITS POLYMORPHS THEREOF | MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) | 2018-05-24 | — | — | WO | disclosed |