Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 5/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.46 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.46 |
| ▸ | TNKS | O95271 | 1/20 | 0.44 |
| ▸ | GABRP | O00591 | 4/20 | 0.44 |
| ▸ | GABRD | O14764 | 4/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.44 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.44 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.44 |
| ▸ | GABRE | P78334 | 4/20 | 0.44 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.44 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.44 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23926997 | 0.79 | LMNA (0.48) | AURKAHSP90AA1TNKSGABRPGABRD | |
| SCHEMBL28488249 | 0.79 | TNKS (0.47) | AURKAHSP90AA1CDK5CDK5R1TNKS | |
| SCHEMBL3846775 | 0.78 | HSP90AA1 (0.49) | AURKAHSP90AA1CDK5CDK5R1GABRP | |
| SCHEMBL6696416 | 0.78 | CDK5 (0.51) | AURKAHSP90AA1CDK5CDK5R1GABRP | |
| SCHEMBL5956445 | 0.78 | CDK5 (0.53) | AURKAHSP90AA1CDK5CDK5R1TNKS | |
| SCHEMBL28486773 | 0.78 | AURKA (0.49) | AURKAHSP90AA1CDK5CDK5R1GABRP | |
| SCHEMBL16456379 | 0.77 | AURKA (0.53) | AURKAHSP90AA1CDK5CDK5R1TNKS | |
| SCHEMBL18386767 | 0.75 | CDK5 (0.51) | AURKAHSP90AA1CDK5CDK5R1GABRP | |
| SCHEMBL4161172 | 0.75 | GABRP (0.53) | AURKAHSP90AA1CDK5CDK5R1TNKS | |
| SCHEMBL30423157 | 0.75 | GABRP (0.53) | AURKAHSP90AA1CDK5CDK5R1TNKS |
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 |