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 | |
|---|---|---|---|---|
| SCHEMBL1709495 | 0.68 | MEN1 (0.38) | NPSR1 | |
| SCHEMBL10033086 | 0.67 | KDM1A (0.40) | TSHR | |
| SCHEMBL20664064 | 0.62 | THRB (0.44) | — | |
| SCHEMBL20934549 | 0.62 | THRB (0.44) | — | |
| SCHEMBL25263661 | 0.62 | THRB (0.44) | — | |
| SCHEMBL25919102 | 0.62 | LIPA (0.36) | — | |
| SCHEMBL29117712 | 0.61 | ALDH1A1 (0.35) | TSHRNPSR1 | |
| SCHEMBL10455924 | 0.61 | KMT2A (0.39) | — | |
| Hydrochloric Acid SCHEMBL25302442 | 0.61 | THRB (0.42) | — | |
| Hydrochloric Acid SCHEMBL25302443 | 0.61 | THRB (0.42) | — |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |