Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.37 |
| ▸ | P2RX2 | Q9UBL9 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | RAPGEF3 | O95398 | 2/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16691744 | 0.81 | NPSR1 (0.40) | NPSR1MAP4K1ABL1P2RX3P2RX2 | |
| SCHEMBL879707 | 0.80 | TSHR (0.41) | POLBTSHRALDH1A1NPSR1HSD17B10 | |
| SCHEMBL850490 | 0.78 | ALDH1A1 (0.40) | POLBTSHRALDH1A1NPSR1HSD17B10 | |
| SCHEMBL850491 | 0.78 | ALDH1A1 (0.40) | POLBTSHRALDH1A1NPSR1HSD17B10 | |
| SCHEMBL16480407 | 0.77 | PER2 (0.40) | MAP4K1ABL1P2RX3P2RX2SLC6A2 | |
| SCHEMBL16480426 | 0.76 | SLC6A2 (0.53) | ALDH1A1ABL1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9893055 | 0.76 | PARP1 (0.43) | ABL1SLC6A2SLC6A4SLC6A3CCNA2 | |
| SCHEMBL849497 | 0.76 | TSHR (0.38) | POLBTSHRALDH1A1NPSR1HSD17B10 | |
| SCHEMBL849498 | 0.76 | TSHR (0.38) | POLBTSHRALDH1A1NPSR1HSD17B10 | |
| SCHEMBL10131414 | 0.76 | CYP3A4 (0.41) | TSHRABL1SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010126030-A1 | SPIROIMIDAZOLONE DERIVATIVE | 中外製薬株式会社 (JP) | 2010-11-04 | — | — | WO | disclosed |