Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 11/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.38 |
| ▸ | ARG1 | P05089 | 4/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL7494075 | 1.00 | CCR5 (0.40) | CCR5RIPK1NTRK1ARG1PDE5A | |
| SCHEMBL7604524 | 0.89 | CCR5 (0.39) | CCR5RIPK1NTRK1ARG1KCNH2 | |
| SCHEMBL7982834 | 0.88 | CCR5 (0.44) | CCR5RIPK1NTRK1 | |
| SCHEMBL7501730 | 0.88 | CCR5 (0.44) | CCR5RIPK1NTRK1 | |
| SCHEMBL7606529 | 0.87 | CCR5 (0.38) | CCR5NTRK1ARG1KCNH2 | |
| SCHEMBL4104243 | 0.85 | CCR5 (0.57) | CCR5KCNH2 | |
| SCHEMBL7931851 | 0.84 | CCR5 (0.39) | CCR5RIPK1PDE5AKCNH2 | |
| SCHEMBL7940994 | 0.84 | CCR5 (0.39) | CCR5RIPK1PDE5AKCNH2 | |
| SCHEMBL7492511 | 0.84 | CCR5 (0.39) | CCR5RIPK1PDE5AKCNH2 | |
| SCHEMBL6105560 | 0.84 | ARG1 (0.55) | CCR5RIPK1NTRK1ARG1 |
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-6248755-B1 | ANTIINFLAMMATORY AGENTS; ANTIALLERGENS; AUTOIMMUNE DISEASES | MERCK & CO., INC. | 2001-06-19 | — | — | US | disclosed |