Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.33 |
| ▸ | FEN1 | P39748 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30615400 | 0.83 | UHRF1 (0.50) | CD44MAPTFGFR1KDM4ETDP1 | |
| SCHEMBL21463872 | 0.83 | UHRF1 (0.50) | CD44MAPTFGFR1KDM4ETDP1 | |
| SCHEMBL30615386 | 0.81 | CD44 (0.41) | CD44MAPTFGFR1KDM4ETDP1 | |
| SCHEMBL21463290 | 0.81 | CD44 (0.41) | CD44MAPTFGFR1KDM4ETDP1 | |
| SCHEMBL21463467 | 0.78 | NNMT (0.45) | CD44MAPTFGFR1KDM4EPIK3CA | |
| SCHEMBL30615694 | 0.78 | NNMT (0.45) | CD44MAPTFGFR1KDM4EPIK3CA | |
| SCHEMBL21463762 | 0.75 | CD44 (0.45) | CD44GRM5KDM4ETDP1CYP3A4 | |
| SCHEMBL27897076 | 0.71 | LCK (0.51) | CD44CYP3A4CYP2C19LCKCYP17A1 | |
| SCHEMBL2067650 | 0.70 | — | — | |
| SCHEMBL25053429 | 0.70 | GRM5 (0.49) | GRM5ALOX5APFEN1CYP3A4NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111868037-B | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2023-10-13 | — | — | CN | disclosed |
| CN-111868037-A | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2020-10-30 | — | — | CN | disclosed |