Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 3/20 | 0.54 |
| ▸ | AXL | P30530 | 2/20 | 0.54 |
| ▸ | NUDT1 | P36639 | 4/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 3/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.38 |
| ▸ | IGF1R | P08069 | 2/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | CHUK | O15111 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PAK4 | O96013 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28609105 | 1.00 | PRKCI (0.54) | PRKCIAXLNUDT1CYP17A1CYP11B1 | |
| SCHEMBL28602236 | 0.83 | NUDT1 (0.68) | PRKCIAXLNUDT1CYP17A1CYP11B1 | |
| SCHEMBL30173320 | 0.83 | NUDT1 (0.68) | PRKCIAXLNUDT1CYP17A1CYP11B1 | |
| SCHEMBL30173327 | 0.83 | NUDT1 (0.68) | PRKCIAXLNUDT1CYP17A1CYP11B1 | |
| SCHEMBL3725709 | 0.82 | JAK2 (0.58) | PRKCIAXLNUDT1MAPK1JAK2 | |
| SCHEMBL30173305 | 0.82 | JAK2 (0.58) | PRKCIAXLNUDT1MAPK1JAK2 | |
| SCHEMBL30173316 | 0.79 | AXL (0.61) | PRKCIAXLNUDT1JAK2AURKB | |
| SCHEMBL28609163 | 0.79 | AXL (0.61) | PRKCIAXLNUDT1JAK2AURKB | |
| SCHEMBL28598985 | 0.79 | AXL (0.53) | PRKCIAXLNUDT1MAPK1JAK2 | |
| SCHEMBL30173343 | 0.79 | AXL (0.53) | PRKCIAXLNUDT1MAPK1JAK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113200983-B | Compound with pyrrolopyridine structure, preparation method and medical application | 中国药科大学 | 2023-01-03 | — | — | CN | disclosed |