Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 15/20 | 0.51 |
| ▸ | AURKA | O14965 | 4/20 | 0.43 |
| ▸ | KDR | P35968 | 4/20 | 0.43 |
| ▸ | CDK7 | P50613 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3043818 | 0.99 | CHEK1 (0.51) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3033944 | 0.99 | CHEK1 (0.50) | CHEK1AURKAKDRCDK7 | |
| Hydrochloric Acid SCHEMBL3047303 | 0.97 | CHEK1 (0.47) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3151512 | 0.93 | CHEK1 (0.43) | CHEK1AURKAKDRCDK7 | |
| SCHEMBL3044844 | 0.93 | CHEK1 (0.47) | CHEK1AURKAKDR | |
| Hydrochloric Acid SCHEMBL3158721 | 0.92 | CHEK1 (0.43) | CHEK1AURKAKDR | |
| SCHEMBL3048647 | 0.92 | CHEK1 (0.46) | CHEK1AURKAKDRCDK7 | |
| Hydrochloric Acid SCHEMBL3156819 | 0.92 | CHEK1 (0.43) | CHEK1AURKAKDRCDK7 | |
| Hydrochloric Acid SCHEMBL3040232 | 0.92 | CHEK1 (0.46) | CHEK1AURKAKDR | |
| Hydrochloric Acid SCHEMBL3039411 | 0.91 | CHEK1 (0.45) | 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 |
|---|---|---|---|---|---|---|---|
| US-7745641-B2 | Nitrogen-containing heterocyclic compound | KYOWA HAKKO KIRIN CO., LTD. (JP) | 2010-06-29 | — | — | US | claimed |