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 | |
|---|---|---|---|---|
| SCHEMBL6039639 | 0.90 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL6039434 | 0.88 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL30684715 | 0.73 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL4630957 | 0.72 | EPHX1 (0.35) | MCL1ALDH1A1 | |
| SCHEMBL15540841 | 0.70 | — | — | |
| SCHEMBL10244794 | 0.69 | CHRNB2 (0.41) | ALDH1A1 | |
| SCHEMBL18378505 | 0.68 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL18925122 | 0.68 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL5101070 | 0.67 | FFAR1 (0.40) | — | |
| SCHEMBL13996836 | 0.67 | ALDH1A1 (0.36) | ALDH1A1 |
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-2006038001-A1 | AMINOPYRIMIDINE DERIVATIVES AS JNK INHIBITORS | CELLTECH R & D LIMITED (GB) | 2006-04-13 | — | — | WO | disclosed |