Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL28754639 | 0.92 | ESR1 (0.39) | ESR1POLB | |
| SCHEMBL27617674 | 0.90 | CYP1A2 (0.32) | ESR1 | |
| SCHEMBL27617676 | 0.81 | ALDH1A1 (0.32) | ESR1 | |
| SCHEMBL27636772 | 0.81 | ESR1 (0.34) | ESR1 | |
| SCHEMBL5213479 | 0.81 | PSEN1 (0.41) | ESR1 | |
| SCHEMBL27636777 | 0.80 | ESR1 (0.38) | ESR1 | |
| SCHEMBL28754625 | 0.79 | CYP1A2 (0.33) | ESR1 | |
| SCHEMBL27636716 | 0.76 | CTSK (0.34) | ESR1 | |
| SCHEMBL27636697 | 0.75 | PTPRC (0.35) | — | |
| SCHEMBL27617735 | 0.72 | GAA (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1720231-A | Substituted dihydrophenanthridinesulfonamides | WYETH CORP (US) | 2006-01-11 | — | — | CN | disclosed |