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 | |
|---|---|---|---|---|
| SCHEMBL12707568 | 1.00 | TDP1 (0.30) | TDP1TSHR | |
| SCHEMBL7081832 | 1.00 | TDP1 (0.30) | TDP1TSHR | |
| SCHEMBL18419251 | 0.97 | TSHR (0.32) | TDP1TSHR | |
| SCHEMBL5358136 | 0.97 | — | — | |
| SCHEMBL9843480 | 0.94 | CES2 (0.30) | TDP1TSHR | |
| SCHEMBL15003813 | 0.94 | CES2 (0.30) | TDP1TSHR | |
| SCHEMBL10981383 | 0.91 | UGT2B7 (0.31) | — | |
| SCHEMBL5326361 | 0.90 | — | — | |
| SCHEMBL16448668 | 0.90 | — | — | |
| SCHEMBL13980744 | 0.78 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| EP-2314598-A1 | Inhibitors of Hepatitis C virus NS3 serine protease | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-04-27 | — | — | EP | disclosed |