Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 1/20 | 1.00 |
| ▸ | SCD | O00767 | 10/20 | 0.94 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.74 |
| ▸ | FADS1 | O60427 | 1/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.70 |
| ▸ | CBFB | Q13951 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL913121 | 0.97 | SCD (1.00) | NPBWR1SCDHDAC6FADS1CYP2C9 | |
| SCHEMBL914199 | 0.88 | NPBWR1 (0.79) | NPBWR1SCDHDAC6FADS1CBFB | |
| SCHEMBL12568424 | 0.88 | NPBWR1 (0.79) | NPBWR1SCDHDAC6FADS1CYP1A2 | |
| SCHEMBL914082 | 0.87 | NPBWR1 (0.76) | NPBWR1SCDHDAC6FADS1CYP1A2 | |
| SCHEMBL913403 | 0.86 | SCD (0.76) | NPBWR1SCDFADS1 | |
| SCHEMBL913851 | 0.86 | SCD (0.79) | NPBWR1SCDFADS1 | |
| SCHEMBL913129 | 0.86 | SCD (0.79) | NPBWR1SCDFADS1 | |
| Ensulizole SCHEMBL3173657 | 0.85 | NPBWR1 (0.74) | NPBWR1SCDHDAC6CYP1A2CYP2C9 | |
| SCHEMBL1586575 | 0.85 | NPBWR1 (0.74) | NPBWR1SCDHDAC6CYP1A2CYP2C9 | |
| SCHEMBL15640487 | 0.85 | CHEK2 (0.79) | NPBWR1SCDHDAC6CYP1A2CYP2C9 |
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-7345090-B2 | Galenical formulation | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 2008-03-18 | — | — | US | disclosed |