Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.52 |
| ▸ | CES1 | P23141 | 4/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.43 |
| ▸ | PPARG | P37231 | 6/20 | 0.43 |
| ▸ | PPARD | Q03181 | 6/20 | 0.43 |
| ▸ | PPARA | Q07869 | 6/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21219001 | 0.81 | CES2 (0.68) | CES2CES1AKR1B1HAO1GPR84 | |
| SCHEMBL183878 | 0.81 | CES2 (0.68) | CES2CES1AKR1B1HAO1GPR84 | |
| SCHEMBL2904003 | 0.81 | CES2 (0.68) | CES2CES1AKR1B1HAO1GPR84 | |
| SCHEMBL429975 | 0.81 | CES2 (0.68) | CES2CES1AKR1B1HAO1GPR84 | |
| SCHEMBL277151 | 0.76 | FNTA (0.57) | CES2CES1AKR1B1GPR84PPARG | |
| SCHEMBL6206987 | 0.76 | CES1 (0.52) | CES2CES1AKR1B1FAAHHAO1 | |
| SCHEMBL3903484 | 0.75 | CES2 (0.65) | CES2CES1FAAHGPR84PPARG | |
| SCHEMBL6545373 | 0.74 | FNTA (0.60) | CES2CES1AKR1B1GPR84PPARG | |
| SCHEMBL128063 | 0.74 | CES2 (0.74) | CES2CES1AKR1B1HAO1GPR84 | |
| SCHEMBL6206597 | 0.73 | CES2 (0.52) | CES2CES1AKR1B1FAAHHAO1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1532128-A1 | INHIBITORS OF HCV NS5B POLYMERASE | Pharmacia & Upjohn Company LLC (US) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004002977-A1 | INHIBITORS OF HCV NS5B POLYMERASE | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-01-08 | — | — | WO | disclosed |