Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 17/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | CDK7 | P50613 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5133467 | 0.80 | KDR (0.47) | — | |
| SCHEMBL5050597 | 0.78 | HTT (0.45) | CHEK1KDM4EALDH1A1POLBCDK7 | |
| Hydrochloric Acid SCHEMBL3047166 | 0.78 | AURKA (0.49) | CHEK1KDM4EALDH1A1POLB | |
| SCHEMBL19458698 | 0.75 | CHEK1 (0.57) | CHEK1 | |
| SCHEMBL5132461 | 0.75 | PRMT5 (0.42) | FFAR1 | |
| SCHEMBL5046867 | 0.75 | CHEK1 (0.53) | CHEK1CDK7 | |
| SCHEMBL3856005 | 0.75 | CHEK1 (0.58) | CHEK1CDK7 | |
| SCHEMBL15520072 | 0.75 | CHEK1 (0.57) | CHEK1 | |
| SCHEMBL14311032 | 0.73 | MAPT (0.50) | CHEK1KDM4EALDH1A1POLB | |
| SCHEMBL5134533 | 0.73 | FFAR1 (0.43) | FFAR1 |
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 |