Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 6/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | GPR183 | P32249 | 1/20 | 0.38 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13544004 | 0.94 | CCR5 (0.46) | CCR5OPRM1TACR1 | |
| SCHEMBL5510972 | 0.88 | CCR5 (0.44) | CCR5OPRM1TACR1PDE4APDE4B | |
| SCHEMBL4680501 | 0.86 | CCR5 (0.45) | CCR5OPRM1TACR1PDE4APDE4B | |
| SCHEMBL13543990 | 0.81 | CCR5 (0.44) | CCR5TACR1 | |
| SCHEMBL27228860 | 0.79 | OPRM1 (0.46) | CCR5OPRM1TACR1USP30RORC | |
| SCHEMBL13543991 | 0.79 | CCR5 (0.43) | CCR5TACR1 | |
| SCHEMBL8563070 | 0.79 | CCR5 (0.41) | CCR5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3118407 | 0.79 | CCR5 (0.47) | CCR5TACR1USP30RORCSCD5 | |
| SCHEMBL1280507 | 0.79 | USP2 (0.41) | CCR5OPRM1 | |
| SCHEMBL14415546 | 0.79 | CCR5 (0.51) | CCR5OPRM1TACR1PDE4APDE4B |
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 |
|---|---|---|---|---|---|---|---|
| US-7271172-B2 | Pyrrolidine and azetidine compounds as CCR5 antagonists | SMITHKLINE BEECHAM CORPORATION (US) | 2007-09-18 | — | — | US | disclosed |