Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bardoxolone Methyl. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 known ✓ | Q16236 | 3/20 | 1.00 |
| ▸ | KEAP1 known ✓ | Q14145 | 2/20 | 0.83 |
| ▸ | MBOAT4 | Q96T53 | 4/20 | 1.00 |
| ▸ | USP7 | Q93009 | 2/20 | 1.00 |
| ▸ | USP2 | O75604 | 1/20 | 1.00 |
| ▸ | STAT3 | P40763 | 1/20 | 1.00 |
| ▸ | RORC | P51449 | 1/20 | 0.86 |
| ▸ | NOS2 | P35228 | 9/20 | 0.83 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.83 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.83 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.83 |
| ▸ | CCR6 | P51684 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| Bardoxolone Methyl SCHEMBL18910897 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL15184347 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL19635256 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL91615 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL12521530 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL23896957 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL702067 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL21577829 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL22213797 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 | |
| Bardoxolone Methyl SCHEMBL25906069 | 1.00 | MBOAT4 (1.00) | MBOAT4NFE2L2USP7USP2STAT3 |
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-20170056373-A1 | GHRELIN O-ACYLTRANSFERASE INHIBITORS | SYRACUSE UNIVERSITY (US) | 2017-03-02 | — | — | US | disclosed |