Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 4/20 | 0.40 |
| ▸ | GABRD | O14764 | 4/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21463622 | 1.00 | ADORA3 (0.43) | ADORA3DYRK1AALDH1A1HSD17B10MAPT | |
| SCHEMBL21467350 | 0.89 | MAPT (0.42) | ALDH1A1HSD17B10MAPTHPGDKDM4E | |
| SCHEMBL30615322 | 0.84 | ADORA3 (0.52) | ADORA3ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL28488324 | 0.84 | ADORA3 (0.52) | ADORA3ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL28487839 | 0.81 | DAO (0.45) | ADORA3ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL30615526 | 0.81 | AURKA (0.41) | MAPTGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28495313 | 0.81 | AURKA (0.41) | MAPTGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL30615441 | 0.80 | DAO (0.44) | ADORA3ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL28488183 | 0.80 | DAO (0.44) | ADORA3ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL28497610 | 0.74 | DAO (0.45) | ADORA3ALDH1A1HSD17B10MAPTHPGD |
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-111868037-B | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2023-10-13 | — | — | CN | disclosed |