Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 18/20 | 0.56 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30095362 | 1.00 | MAP3K5 (0.56) | MAP3K5CYP17A1GRM5 | |
| SCHEMBL28899163 | 0.80 | MAP3K5 (0.52) | MAP3K5 | |
| SCHEMBL30095502 | 0.80 | MAP3K5 (0.52) | MAP3K5 | |
| SCHEMBL28537150 | 0.79 | MAP3K5 (0.52) | MAP3K5CYP17A1GRM5 | |
| SCHEMBL10222569 | 0.78 | MAP3K5 (0.47) | MAP3K5 | |
| SCHEMBL23638696 | 0.73 | MAP3K5 (1.00) | MAP3K5 | |
| SCHEMBL30095507 | 0.68 | IP6K1 (0.55) | MAP3K5 | |
| SCHEMBL28899189 | 0.68 | IP6K1 (0.55) | MAP3K5 | |
| SCHEMBL22473968 | 0.68 | MAP3K5 (0.46) | MAP3K5 | |
| SCHEMBL28899176 | 0.68 | MAP3K5 (0.47) | MAP3K5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109456308-B | Heterocyclic compounds as ASK inhibitors and their use | 南京圣和药业股份有限公司 | 2022-11-29 | — | — | CN | disclosed |
| CN-109071498-B | Kinase inhibitor and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2021-03-30 | — | — | CN | disclosed |
| CN-109456308-A | Heterocyclic compound and its application as ASK inhibitor | 南京圣和药业股份有限公司 | 2019-03-12 | — | — | CN | disclosed |