Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.69 |
| ▸ | AURKA | O14965 | 1/20 | 0.69 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.69 |
| ▸ | CDK8 | P49336 | 1/20 | 0.69 |
| ▸ | NEK2 | P51955 | 1/20 | 0.69 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.69 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.69 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.69 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320433 | 0.85 | MPO (0.49) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL23320456 | 0.82 | CHEK1 (1.00) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL30323998 | 0.75 | CHEK1 (0.70) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL23320357 | 0.74 | NAMPT (0.56) | — | |
| SCHEMBL23320448 | 0.73 | PRMT3 (0.48) | KDM4ESMN1; SMN2 | |
| SCHEMBL23320350 | 0.72 | CHEK1 (0.62) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL9910900 | 0.67 | CHEK1 (0.59) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL9910899 | 0.66 | CHEK1 (0.70) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL23320374 | 0.66 | CHEK1 (0.58) | CHEK1AURKACSNK1A1CDK8NEK2 | |
| SCHEMBL17129942 | 0.66 | CHEK1 (0.62) | CHEK1AURKACSNK1A1CDK8NEK2 |
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-112654608-B | Fused ring compound having urea structure | 桑福德伯纳姆普利斯医学发现研究所 | 2024-05-07 | — | — | CN | disclosed |