Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 8/20 | 0.38 |
| ▸ | THRB | P10828 | 8/20 | 0.38 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.34 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.34 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5116725 | 0.80 | THRA (0.60) | THRATHRBNR3C1NR3C2ESR1 | |
| SCHEMBL5310031 | 0.79 | THRA (0.41) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL5311039 | 0.78 | THRA (0.40) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL4356784 | 0.78 | THRA (0.40) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL5308746 | 0.77 | THRA (0.36) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL14540614 | 0.76 | THRA (0.38) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL5310191 | 0.76 | THRA (0.38) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL5309606 | 0.76 | THRA (0.38) | THRATHRBNR3C1CYP1A2CYP3A4 | |
| SCHEMBL5111310 | 0.72 | THRA (0.59) | THRATHRBNR3C1NR3C2ESR1 | |
| SCHEMBL5112565 | 0.71 | THRA (0.63) | THRATHRBNR3C1NR3C2ESR1 |
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-2007039125-A2 | AN OPTICALLY ACTIVE THYROID RECEPTOR AGONIST AND OPTICALLY ACTIVE KEY INTERMEDIATES IN ITS PRODUCTION | KARO BIO AB (SE) | 2007-04-12 | — | — | WO | disclosed |