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 | |
|---|---|---|---|---|
| SCHEMBL9963212 | 0.83 | ALDH1A1 (0.36) | EPHX2HDAC6 | |
| SCHEMBL18266914 | 0.79 | PKM (0.37) | EPHX2HDAC6 | |
| SCHEMBL16081991 | 0.79 | PKM (0.37) | EPHX2HDAC6 | |
| SCHEMBL30962423 | 0.76 | CYP1A2 (0.36) | EPHX2HDAC6 | |
| SCHEMBL25017626 | 0.73 | HDAC6 (0.30) | EPHX2HDAC6 | |
| SCHEMBL1829308 | 0.71 | EPHX2 (0.45) | EPHX2HDAC6 | |
| SCHEMBL25017182 | 0.71 | — | — | |
| SCHEMBL18010976 | 0.70 | ATM (0.40) | EPHX2HDAC6 | |
| SCHEMBL25018158 | 0.69 | LMNA (0.32) | — | |
| SCHEMBL11323804 | 0.69 | — | — |
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-2004080958-A2 | PROCESS TO TETRAHYDROTRIAZOLOPYRAZINES AND INTERMEDIATES | MERCK & CO. INC. (US) | 2004-09-23 | — | — | WO | disclosed |