Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 16/20 | 0.43 |
| ▸ | AURKA | O14965 | 3/20 | 0.40 |
| ▸ | KDR | P35968 | 3/20 | 0.40 |
| ▸ | CDK7 | P50613 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3050822 | 0.86 | CHEK1 (0.45) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3039315 | 0.86 | CHEK1 (0.42) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3039404 | 0.86 | CHEK1 (0.47) | CHEK1AURKAKDRCDK7 | |
| Hydrochloric Acid SCHEMBL3034106 | 0.86 | CHEK1 (0.47) | CHEK1AURKAKDRCDK7TSHR | |
| SCHEMBL3040222 | 0.86 | CHEK1 (0.48) | CHEK1AURKAKDR | |
| SCHEMBL3048839 | 0.85 | AURKA (0.42) | CHEK1AURKAKDR | |
| SCHEMBL3043821 | 0.85 | CHEK1 (0.41) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3046134 | 0.85 | CHEK1 (0.44) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3048160 | 0.85 | CHEK1 (0.45) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3050852 | 0.85 | CHEK1 (0.49) | CHEK1AURKAKDRCDK7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1880993-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2008-01-23 | — | — | EP | disclosed |