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 | |
|---|---|---|---|---|
| SCHEMBL1698226 | 0.95 | CXCR4 (0.41) | CXCR4KCNH2 | |
| SCHEMBL19435835 | 0.92 | CXCR4 (0.40) | CXCR4KCNH2 | |
| SCHEMBL1698196 | 0.92 | CXCR4 (0.43) | CXCR4KCNH2 | |
| SCHEMBL1698222 | 0.89 | CXCR4 (0.44) | CXCR4KCNH2 | |
| SCHEMBL1698199 | 0.88 | OPRL1 (0.36) | CXCR4KCNH2 | |
| SCHEMBL1698217 | 0.88 | CXCR4 (0.42) | CXCR4KCNH2 | |
| SCHEMBL12070440 | 0.85 | CXCR4 (0.41) | CXCR4KCNH2 | |
| SCHEMBL1698219 | 0.84 | DRD2 (0.38) | CXCR4KCNH2 | |
| SCHEMBL1698203 | 0.81 | OPRL1 (0.34) | KCNH2 | |
| SCHEMBL1698223 | 0.81 | OPRL1 (0.40) | CXCR4KCNH2 |
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-2011160254-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-12-29 | — | — | WO | disclosed |