Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.48 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3920117 | 0.93 | CYP2C9 (0.56) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3920627 | 0.92 | CYP2C9 (0.47) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3919559 | 0.91 | CYP2C9 (0.46) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3918627 | 0.91 | CYP2C9 (0.46) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3930787 | 0.90 | CYP2C9 (0.43) | CYP2C9NR1I2KDM4EHDAC1HDAC8 | |
| SCHEMBL3922130 | 0.89 | PIK3R1 (0.44) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3917989 | 0.86 | CYP2C9 (0.42) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3929284 | 0.84 | CYP2C9 (0.41) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3922914 | 0.84 | CYP2C9 (0.39) | CYP2C9PIK3R1PIK3CANR1I2KDM4E | |
| SCHEMBL3920019 | 0.83 | CYP2C9 (0.50) | CYP2C9NR1I2KDM4ELMNANPSR1 |
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-1786807-B1 | HETEROCYCLIC ANTIVIRAL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2009-07-29 | — | — | EP | claimed |