Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OTUD7B | Q6GQQ9 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 7/20 | 0.38 |
| ▸ | CCNC | P24863 | 6/20 | 0.38 |
| ▸ | CDK19 | Q9BWU1 | 2/20 | 0.38 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.36 |
| ▸ | SPR | P35270 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | TYK2 | P29597 | 2/20 | 0.34 |
| ▸ | SMO | Q99835 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL745671 | 0.90 | OTUD7B (0.40) | OTUD7BCDK8CCNCCDK19CALCRL | |
| SCHEMBL19852880 | 0.79 | OTUD7B (0.43) | OTUD7BCDK8CCNCCDK19CALCRL | |
| SCHEMBL19852881 | 0.79 | OTUD7B (0.43) | OTUD7BCDK8CCNCCALCRLSPR | |
| SCHEMBL29360897 | 0.79 | OTUD7B (0.43) | OTUD7BCDK8CCNCCALCRLSPR | |
| SCHEMBL18702126 | 0.79 | OTUD7B (0.43) | OTUD7BCDK8CCNCCALCRLSPR | |
| SCHEMBL24339014 | 0.77 | OTUD7B (0.39) | OTUD7BCDK8CCNCCALCRLSPR | |
| SCHEMBL18711886 | 0.77 | OTUD7B (0.46) | OTUD7BCDK8CCNCSPRJAK1 | |
| SCHEMBL2338577 | 0.75 | CCNC (0.49) | OTUD7BCDK8CCNC | |
| SCHEMBL4072997 | 0.75 | OTUD7B (0.47) | OTUD7BCDK8CCNCCALCRLSPR | |
| SCHEMBL19852883 | 0.74 | ITGB3 (0.42) | OTUD7BCALCRL |
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-2018026779-A1 | SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF | APTINYX INC. (US) | 2018-02-08 | — | — | WO | disclosed |