Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 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 | |
|---|---|---|---|---|
| SCHEMBL23886934 | 1.00 | TSHR (0.38) | TSHRPTGDR2PDE4BPTPN1PIM1 | |
| SCHEMBL5274226 | 0.82 | TSHR (0.41) | TSHRPTGDR2PDE4BPTPN1CNR2 | |
| SCHEMBL1714808 | 0.80 | TSHR (0.39) | TSHRPTGDR2PDE4BPTPN1PIM1 | |
| SCHEMBL5320886 | 0.76 | TSHR (0.37) | TSHRPTGDR2PDE4BPTPN1CNR2 | |
| SCHEMBL6788039 | 0.75 | TSHR (0.38) | TSHRPTGDR2PDE4BPIM1CNR2 | |
| SCHEMBL5330768 | 0.75 | MRGPRX4 (0.43) | TSHRPTGDR2MRGPRX4 | |
| SCHEMBL22946143 | 0.75 | TSHR (0.41) | TSHRPTGDR2PDE4BPTPN1CNR2 | |
| SCHEMBL7175438 | 0.75 | PTGDR2 (0.39) | TSHRPTGDR2PDE4BMEN1KMT2A | |
| SCHEMBL21431038 | 0.74 | TSHR (0.40) | TSHRPTGDR2PDE4BPTPN1CNR2 | |
| SCHEMBL6783812 | 0.73 | TSHR (0.39) | TSHRPTGDR2PDE4BPTPN1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1309531-A1 | DERIVATIVES OF 4-(TRIFLUOROMETHYL)-PHENOL AND 4-(TRIFLUOROMETHYLPHENYL)-2-(TETRAHYDROPYRANYL) ETHER AND METHOD FOR PRODUCING THE SAME | BASF AKTIENGESELLSCHAFT (DE) | 2003-05-14 | — | — | EP | disclosed |
| WO-2002014250-A1 | DERIVATIVES OF 4-(TRIFLUOROMETHYL)-PHENOL AND 4-(TRIFLUOROMETHYLPHENYL)-2-(TETRAHYDROPYRANYL) ETHER AND METHOD FOR PRODUCING THE SAME | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-21 | — | — | WO | disclosed |