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 | |
|---|---|---|---|---|
| SCHEMBL9935951 | 0.72 | — | — | |
| SCHEMBL50400 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TSHR | |
| SCHEMBL7666190 | 0.70 | TGFBR1 (0.33) | — | |
| SCHEMBL31528451 | 0.69 | ALDH1A1 (0.37) | ALDH1A1TSHR | |
| SCHEMBL3980744 | 0.67 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL2533660 | 0.67 | TSHR (0.38) | ALDH1A1TSHR | |
| SCHEMBL3805655 | 0.65 | TSHR (0.37) | ALDH1A1TSHR | |
| Ammonia Solution, Strong SCHEMBL11023618 | 0.65 | ALDH1A1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL98033 | 0.65 | — | — | |
| SCHEMBL28019597 | 0.65 | — | — |
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-2007098124-A2 | PROCESSES FOR THE CONVERGENT SYNTHESIS OF CALICHEAMICIN DERIVATIVES | WYETH (US) | 2007-08-30 | — | — | WO | disclosed |