Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | CPT2 | P23786 | 1/20 | 0.41 |
| ▸ | ACLY | P53396 | 1/20 | 0.41 |
| ▸ | PGD | P52209 | 1/20 | 0.33 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7534978 | 0.87 | CPT2 (0.43) | TSHRCYP2C9PDE4ACPT2ACLY | |
| SCHEMBL5859283 | 0.84 | TSHR (0.41) | TSHRCYP2C9PDE4ACPT2ACLY | |
| SCHEMBL30970938 | 0.79 | PDE4A (0.43) | PDE4ACPT2ACLYOR51E2 | |
| SCHEMBL2935030 | 0.74 | CPT2 (0.39) | PDE4ACPT2ACLYOR51E2 | |
| SCHEMBL21313126 | 0.74 | CPT2 (0.39) | PDE4ACPT2ACLYOR51E2 | |
| SCHEMBL27509647 | 0.73 | SMN1; SMN2 (0.43) | CYP2C9PDE4A | |
| SCHEMBL722150 | 0.73 | TSHR (0.43) | TSHRCYP2C9PDE4ACPT2ACLY | |
| SCHEMBL722576 | 0.73 | ACLY (0.64) | TSHRCYP2C9PDE4ACPT2ACLY | |
| SCHEMBL22833252 | 0.73 | TSHR (0.43) | TSHRCYP2C9PDE4ACPT2ACLY | |
| SCHEMBL5356598 | 0.73 | TSHR (0.43) | TSHRCYP2C9PDE4ACPT2ACLY |
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-5731467-A | OXIDATIVE DEGRADATION OF 5-KETOGLUCONIC ACID IN ALKALINE MEDIUM | ROQUETTE FRERES (FR) | 1998-03-24 | — | — | US | disclosed |