Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7673324 | 0.89 | CCR1 (0.47) | SIGMAR1CYP2D6CCR1 | |
| SCHEMBL7675434 | 0.83 | SIGMAR1 (0.50) | SIGMAR1CYP2D6 | |
| SCHEMBL7675085 | 0.80 | CCR1 (0.41) | SIGMAR1CYP2D6CCR1KEAP1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11393579 | 0.79 | SIGMAR1 (0.56) | SIGMAR1 | |
| SCHEMBL7675298 | 0.79 | SIGMAR1 (0.46) | SIGMAR1CYP2D6 | |
| SCHEMBL30089988 | 0.77 | DRD4 (0.46) | SIGMAR1 | |
| SCHEMBL7675241 | 0.77 | DRD4 (0.46) | SIGMAR1 | |
| SCHEMBL7675286 | 0.77 | SIGMAR1 (0.44) | SIGMAR1CYP2D6 | |
| SCHEMBL7678975 | 0.77 | SIGMAR1 (0.44) | SIGMAR1CYP2D6 | |
| SCHEMBL6195779 | 0.76 | SIGMAR1 (0.57) | SIGMAR1CYP2D6 |
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-6387893-B1 | ADRENERGIC BLOCKING AGENT; BENIGN PROSATATIC HYPERPLASIA | MERCK & CO., INC. | 2002-05-14 | — | — | US | disclosed |