Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | XBP1 | P17861 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | CES2 | O00748 | 7/20 | 0.46 |
| ▸ | CES1 | P23141 | 6/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL6205633 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL6205641 | 0.85 | ALDH1A1 (0.62) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL123933 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL123932 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL123931 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| Water SCHEMBL11778081 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL5671121 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL269364 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL393440 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPTMAPK1LMNAXBP1 | |
| SCHEMBL6205634 | 0.74 | CES2 (0.46) | ALDH1A1MAPTMAPK1LMNAXBP1 |
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 |