Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13069213 | 0.83 | CA1 (0.33) | CCR5 | |
| SCHEMBL9871728 | 0.77 | CCR5 (0.35) | CCR5CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL18781502 | 0.77 | CCR5 (0.31) | CCR5 | |
| SCHEMBL22009741 | 0.77 | CCR5 (0.31) | CCR5 | |
| SCHEMBL22009743 | 0.77 | CCR5 (0.31) | CCR5 | |
| SCHEMBL23654554 | 0.77 | CCR5 (0.31) | CCR5 | |
| SCHEMBL19499460 | 0.77 | CCR5 (0.31) | CCR5 | |
| SCHEMBL8948200 | 0.74 | CYP1A2 (0.33) | CCR5 | |
| SCHEMBL20681942 | 0.71 | KCNH2 (0.34) | — | |
| SCHEMBL465209 | 0.70 | CCR5 (0.42) | CCR5CHRNB2CHRNB4CHRNA3CHRNA7 |
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-1781656-B1 | ARYL-SUBSTITUTED POLYCYCLIC AMINES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT | SANOFI AVENTIS DEUTSCHLAND (DE) | 2007-12-19 | — | — | EP | disclosed |