Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.52 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 9/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7194195 | 0.89 | ESR1 (0.49) | CYP3A4CYP1A2CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL7184090 | 0.89 | CYP3A4 (0.52) | CYP3A4CYP1A2CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL7200144 | 0.88 | ESR1 (0.49) | ESR1ESR2ABCG2 | |
| SCHEMBL7200140 | 0.88 | ESR1 (0.49) | ESR1ESR2ABCG2 | |
| SCHEMBL7188150 | 0.87 | CYP1A2 (0.51) | CYP3A4CYP1A2CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL7191960 | 0.86 | CYP3A4 (0.59) | CYP3A4CYP1A2CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL7192245 | 0.85 | CYP3A4 (0.48) | CYP3A4CYP1A2CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL7190395 | 0.84 | CYP1A2 (0.42) | CYP3A4CYP1A2CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL7183887 | 0.84 | ESR1 (0.54) | CYP3A4ESR1ESR2CA12CA1 | |
| SCHEMBL7194282 | 0.83 | ERN1 (0.39) | ESR1ESR2GAAAKR1C3AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0835867-B1 | 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods | LILLY CO ELI (US) | 2003-12-03 | — | — | EP | claimed |