Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 20/20 | 0.78 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.70 |
| ▸ | CCR5 | P51681 | 3/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL4426641 | 1.00 | CCR2 (0.78) | CCR2KCNH2CCR5 | |
| SCHEMBL4415223 | 1.00 | CCR2 (0.78) | CCR2KCNH2CCR5 | |
| SCHEMBL4415221 | 1.00 | CCR2 (0.78) | CCR2KCNH2CCR5 | |
| SCHEMBL4416505 | 0.94 | CCR2 (0.78) | CCR2KCNH2CCR5 | |
| SCHEMBL4416497 | 0.94 | CCR2 (0.78) | CCR2KCNH2CCR5 | |
| SCHEMBL4416500 | 0.94 | CCR2 (0.78) | CCR2KCNH2CCR5 | |
| Trifluoroacetic Acid SCHEMBL4416509 | 0.92 | CCR2 (0.75) | CCR2KCNH2CCR5 | |
| SCHEMBL4412601 | 0.88 | CCR2 (0.90) | CCR2KCNH2CCR5 | |
| SCHEMBL4412598 | 0.88 | CCR2 (0.90) | CCR2KCNH2CCR5 | |
| SCHEMBL4412595 | 0.88 | CCR2 (0.90) | CCR2KCNH2CCR5 |
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-1606255-B1 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL MYERS SQUIBB CO (US) | 2009-11-11 | — | — | EP | disclosed |