Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 1/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.39 |
| ▸ | PDE4A | P27815 | 5/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.39 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.38 |
| ▸ | TBK1 | Q9UHD2 | 5/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.35 |
| ▸ | VEGFA | P15692 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | IKBKE | Q14164 | 3/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20021966 | 0.85 | CSNK2A1 (0.44) | PDE4DPDE4APDE4BPDE4CCSNK2A1 | |
| SCHEMBL20384187 | 0.83 | CSNK2A1 (0.43) | PDE4DPDE4APDE4BPDE4CCSNK2A1 | |
| SCHEMBL19527744 | 0.83 | SYK (0.47) | SYKRAF1BRAFPDE4DPDE4A | |
| SCHEMBL20443368 | 0.81 | MCHR1 (0.43) | PDE4ACSNK2A1KDM4EGAAMAPT | |
| SCHEMBL24252789 | 0.81 | SYK (0.44) | SYKPDE4DPDE4APDE4BPDE4C | |
| SCHEMBL30986494 | 0.80 | SYK (0.40) | SYKRAF1BRAFPDE4DPDE4A | |
| SCHEMBL14320848 | 0.79 | PDE4D (0.55) | SYKRAF1BRAFPDE4DPDE4A | |
| SCHEMBL30507985 | 0.79 | KAT2B (0.50) | SYKPDE4DPDE4APDE4BPDE4C | |
| SCHEMBL25314851 | 0.79 | KAT2B (0.50) | SYKPDE4DPDE4APDE4BPDE4C | |
| SCHEMBL18301635 | 0.79 | SYK (0.41) | SYKRAF1BRAFPDE4DPDE4A |
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-2019141131-A1 | BROMODOMAIN INHIBITOR COMPOUND AND USE THEREOF | 中国科学院上海药物研究所 | 2019-07-25 | — | — | WO | disclosed |