Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 16/20 | 0.47 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23329867 | 0.80 | CD38 (0.52) | CD38 | |
| SCHEMBL23329849 | 0.79 | CD38 (0.64) | CD38KLKB1 | |
| SCHEMBL23329850 | 0.78 | CD38 (0.62) | CD38 | |
| SCHEMBL23329531 | 0.77 | HDAC4 (0.42) | CD38LRRK2 | |
| SCHEMBL23329198 | 0.76 | CD38 (0.38) | CD38GRIN2B | |
| SCHEMBL23329183 | 0.72 | CD38 (0.40) | CD38 | |
| SCHEMBL23304745 | 0.70 | CD38 (0.46) | CD38KLKB1GRIN2B | |
| SCHEMBL23305076 | 0.68 | CD38 (0.45) | CD38KLKB1GRIN2B | |
| SCHEMBL23329533 | 0.67 | CD38 (0.73) | CD38 | |
| SCHEMBL23304645 | 0.65 | CD38 (0.44) | CD38GRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021087087-A1 | N-CYCLOHEXYL-5-(THIAZOL-5-YL)-1H-INDOLE-7-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS CD38 INHIBITORS FOR INCREASING NAD+ AND FOR THE TREATMENT OF E.G. MUSCULAR DISORDERS | MITOBRIDGE INC. (US) | 2021-05-06 | — | — | WO | disclosed |