Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 12/20 | 0.49 |
| ▸ | CES1 | P23141 | 10/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.40 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6207821 | 0.77 | CES2 (0.56) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6206793 | 0.75 | CES2 (0.49) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6206779 | 0.75 | CES2 (0.49) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6206786 | 0.75 | CES2 (0.49) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6206775 | 0.73 | CES2 (0.52) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6205112 | 0.73 | CES2 (0.56) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6207028 | 0.73 | CES2 (0.52) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL6205634 | 0.73 | CES2 (0.46) | CES2CES1TSHRPOLBCYP3A4 | |
| SCHEMBL361897 | 0.72 | CES2 (0.59) | CES2CES1TSHRALDH1A1PRMT1 | |
| SCHEMBL5073645 | 0.71 | CES2 (0.77) | CES2CES1TSHRPOLBCYP3A4 |
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 |