Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 16/20 | 0.71 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.65 |
| ▸ | CDK2AP1 | O14519 | 3/20 | 0.58 |
| ▸ | PARP1 | P09874 | 1/20 | 0.53 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL27657374 | 1.00 | CHEK1 (0.71) | CHEK1USP30CDK2AP1PARP1MAP4K4 | |
| SCHEMBL1563534 | 0.97 | CHEK1 (0.68) | CHEK1USP30CDK2AP1MAP4K4 | |
| SCHEMBL4991807 | 0.93 | CHEK1 (0.61) | CHEK1USP30CDK2AP1PARP1 | |
| SCHEMBL1563523 | 0.92 | USP30 (0.63) | CHEK1USP30CDK2AP1PARP1 | |
| SCHEMBL4994947 | 0.91 | CHEK1 (0.59) | CHEK1USP30CDK2AP1PARP1 | |
| SCHEMBL4219757 | 0.91 | CHEK1 (0.59) | CHEK1USP30CDK2AP1PARP1 | |
| SCHEMBL5004721 | 0.91 | CHEK1 (0.59) | CHEK1USP30CDK2AP1PARP1 | |
| SCHEMBL5001062 | 0.90 | CHEK1 (0.58) | CHEK1USP30CDK2AP1 | |
| SCHEMBL1563670 | 0.89 | USP30 (0.68) | CHEK1USP30PARP1 | |
| SCHEMBL4994970 | 0.88 | CHEK1 (0.56) | CHEK1USP30CDK2AP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2305671-A1 | Thiophene and thiazole derivatives as CHK1 inhibitors | AstraZeneca AB (SE) | 2011-04-06 | — | — | EP | disclosed |
| CN-100584840-C | Substituted heterocyclic compounds and uses thereof | ASTRAZENECA AB | 2010-01-27 | — | — | CN | disclosed |
| CN-1922172-A | Substituted heterocyclic compounds and uses thereof | ASTRAZENECA AB (SE) | 2007-02-28 | — | — | CN | disclosed |