Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.43 |
| ▸ | KCNN3 | Q9UGI6 | 4/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 8/20 | 0.33 |
| ▸ | CDK9 | P50750 | 8/20 | 0.33 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.33 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.33 |
| ▸ | CDK7 | P50613 | 3/20 | 0.32 |
| ▸ | CCNH | P51946 | 3/20 | 0.32 |
| ▸ | CDK4 | P11802 | 2/20 | 0.32 |
| ▸ | CCND1 | P24385 | 2/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CBLB | Q13191 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3460690 | 0.80 | PIK3CG (0.48) | PDE10APIK3CGALDH1A1 | |
| SCHEMBL29344715 | 0.77 | PDE10A (0.67) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL20664459 | 0.77 | PDE10A (0.43) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL13073900 | 0.77 | PDE10A (0.43) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL12364000 | 0.77 | PDE10A (0.43) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL25807858 | 0.74 | CCNT1 (0.54) | CCNT1CDK9CDK7CCNHCDK4 | |
| SCHEMBL21849086 | 0.74 | KDM4E (0.42) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL17690933 | 0.74 | PRKAB2 (0.49) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL9301157 | 0.73 | PDE10A (0.43) | PDE10AKCNN3CCNT1CDK9PIK3CG | |
| SCHEMBL21212195 | 0.73 | PDE10A (0.51) | PDE10ACCNT1CDK9CDK7CCNH |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5319140-A | Antibiotics | HOFFMANN-LA ROCHE INC. (US) | 1994-06-07 | — | — | US | disclosed |
| US-5138066-A | Intermediates for cephalosporins with sulfur-containing oxyimino side chain | HOFFMANN-LA ROCHE, INC. (US) | 1992-08-11 | — | — | US | disclosed |
| US-5073550-A | Bactericides | HOFFMANN-LA ROCHE INC. (US) | 1991-12-17 | — | — | US | disclosed |
| US-5036064-A | Antibiotics | HOFFMANN-LA ROCHE INC. (US) | 1991-07-30 | — | — | US | disclosed |
| EP-0303172-A2 | Oxyimino-cephalosporins | F. HOFFMANN-LA ROCHE AG (CH) | 1989-02-15 | — | — | EP | disclosed |