Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 20/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3463542 | 0.86 | CCR1 (0.53) | CCR1CYP2C19KCNH2 | |
| SCHEMBL3466086 | 0.84 | CCR1 (0.54) | CCR1CYP2C19KCNH2 | |
| SCHEMBL3466173 | 0.83 | CCR1 (0.55) | CCR1CYP2C19KCNH2 | |
| SCHEMBL13163166 | 0.82 | CCR1 (0.72) | CCR1CYP2C19KCNH2 | |
| SCHEMBL3464152 | 0.82 | CCR1 (0.58) | CCR1CYP2C19KCNH2 | |
| SCHEMBL13163849 | 0.82 | CCR1 (0.54) | CCR1CYP2C19KCNH2 | |
| SCHEMBL4452505 | 0.82 | CCR1 (0.54) | CCR1CYP2C19KCNH2 | |
| SCHEMBL3466423 | 0.81 | CCR1 (0.51) | CCR1CYP2C19KCNH2 | |
| SCHEMBL2870646 | 0.81 | CCR1 (0.74) | CCR1CYP2C19KCNH2 | |
| SCHEMBL3463392 | 0.80 | CCR1 (0.73) | CCR1CYP2C19KCNH2 |
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-7589199-B2 | Substituted piperazines | CHEMOCENTRYX, INC. (US) | 2009-09-15 | — | — | US | disclosed |