Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.33 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.31 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22912525 | 0.85 | GAA (0.36) | GAACDC25BCHUKCYP19A1JAK2 | |
| SCHEMBL84373 | 0.79 | GAA (0.46) | GAARPS6KA3CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL25039074 | 0.78 | TRPA1 (0.33) | GAARPS6KA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL2108667 | 0.78 | GAA (0.45) | GAARPS6KA3CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL4408576 | 0.78 | GAA (0.45) | GAARPS6KA3CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL18393135 | 0.78 | PTGS2 (0.36) | GAACYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL20247323 | 0.78 | PTGS2 (0.36) | GAACYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL783489 | 0.77 | CA12 (0.33) | RPS6KA3CYP3A4CHUKTP53MAPT | |
| SCHEMBL13028991 | 0.76 | LMNA (0.48) | GAARPS6KA3CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL14121041 | 0.76 | LMNA (0.48) | GAARPS6KA3CYP3A4CYP2D6SLC6A2 |
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-2017008708-A1 | METHOD FOR PREPARING INDAZOLE COMPOUND AND USE THEREOF | 中国科学院上海药物研究所 | 2017-01-19 | — | — | WO | disclosed |