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 | |
|---|---|---|---|---|
| SCHEMBL6561160 | 1.00 | CYP1A2 (0.35) | CYP1A2RXRA | |
| SCHEMBL6562444 | 0.84 | CYP1A2 (0.32) | CYP1A2 | |
| SCHEMBL6563392 | 0.79 | — | — | |
| SCHEMBL11394565 | 0.74 | MAPT (0.40) | CYP1A2RXRA | |
| SCHEMBL22077232 | 0.67 | FFAR3 (0.39) | CYP1A2RXRA | |
| SCHEMBL4231725 | 0.65 | SHBG (0.34) | CYP1A2 | |
| SCHEMBL4231722 | 0.65 | SHBG (0.34) | CYP1A2 | |
| SCHEMBL9342959 | 0.64 | CYP1A2 (0.51) | CYP1A2RXRA | |
| SCHEMBL22108771 | 0.63 | RXRA (0.31) | RXRA | |
| SCHEMBL22077241 | 0.61 | SLC6A3 (0.34) | — |
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-1144365-B1 | INHIBITORS OF ALPHA-4 BETA-1 MEDIATED CELL ADHESION | TANABE SEIYAKU CO (JP) | 2004-03-17 | — | — | EP | disclosed |