Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 14/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5050560 | 0.87 | MEN1 (0.47) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3052554 | 0.85 | CHEK1 (0.45) | CHEK1ACHEHTR7 | |
| Hydrochloric Acid SCHEMBL3048311 | 0.76 | CHEK1 (0.46) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3046278 | 0.76 | CHEK1 (0.47) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3047166 | 0.76 | AURKA (0.49) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3050509 | 0.74 | CHEK1 (0.48) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3043804 | 0.74 | CHEK1 (0.44) | CHEK1 | |
| SCHEMBL3034550 | 0.74 | CHEK1 (0.47) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3046777 | 0.73 | CHEK1 (0.52) | CHEK1 | |
| Hydrochloric Acid SCHEMBL3043640 | 0.73 | AURKA (0.44) | CHEK1 |
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 |