Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 3/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.37 |
| ▸ | CDK2 | P24941 | 3/20 | 0.37 |
| ▸ | CDK4 | P11802 | 2/20 | 0.37 |
| ▸ | CCND1 | P24385 | 2/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | RB1 | P06400 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 2/20 | 0.33 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL14818596 | 0.81 | CDK1 (0.40) | CDK1CCNB1CDK2CDK4CCND1 | |
| SCHEMBL9915324 | 0.79 | CDK1 (0.38) | CDK1CCNB1CDK2CDK4CCND1 | |
| SCHEMBL16748648 | 0.78 | CDK1 (0.38) | CDK1CCNB1CDK2CDK4CCND1 | |
| SCHEMBL15279041 | 0.76 | ALDH1A1 (0.39) | GAA | |
| SCHEMBL15279055 | 0.74 | CDK1 (0.35) | CDK1CCNB1CDK2CDK4CCND1 | |
| SCHEMBL9915516 | 0.72 | PLA2G4B (0.41) | PTPN11 | |
| SCHEMBL16748696 | 0.71 | PLA2G4B (0.43) | PTPN11 | |
| SCHEMBL15279003 | 0.70 | DAO (0.43) | — | |
| SCHEMBL9291158 | 0.69 | GHSR (0.43) | S1PR3PDE4BKDM4EMEN1KMT2A | |
| SCHEMBL9915491 | 0.67 | SMYD3 (0.45) | PTPN11KDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2646436-B1 | MONOBACTAMS | PFIZER (US) | 2015-05-27 | — | — | EP | disclosed |