Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLP1R | P43220 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CCND2 | P30279 | 1/20 | 0.37 |
| ▸ | CCND3 | P30281 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 11/20 | 0.36 |
| ▸ | CDK2 | P24941 | 11/20 | 0.36 |
| ▸ | KDR | P35968 | 8/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | BCR | P11274 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23196009 | 0.82 | GLP1R (0.41) | GLP1RCA12CA1CA2CA9 | |
| SCHEMBL23195819 | 0.81 | GLP1R (0.50) | GLP1RCA12CA1CA2CA9 | |
| SCHEMBL23195813 | 0.77 | GLP1R (0.38) | GLP1RCA12CA1CA2CA9 | |
| SCHEMBL23196387 | 0.77 | MAPK8 (0.38) | GLP1RCA12CA1CA2CA9 | |
| SCHEMBL23196358 | 0.71 | GLP1R (0.33) | GLP1RCDK4CCND1CCND2CCND3 | |
| SCHEMBL23196348 | 0.71 | GAA (0.58) | SMN1; SMN2 | |
| SCHEMBL3450272 | 0.70 | GRM4 (0.44) | CDK1CDK2KDRALK | |
| SCHEMBL13734929 | 0.70 | CDK1 (0.38) | CDK4CCND1CCND2CCND3CDK1 | |
| SCHEMBL3448927 | 0.70 | CDK1 (0.44) | CA2CDK1CDK2KDR | |
| SCHEMBL3448047 | 0.69 | PTK2 (0.53) | CCND3CDK1CDK2KDRABL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4023642-A1 | JNK INHIBITOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | Wuhan LL Science and Technology Development Co., Ltd. (CN) | 2022-07-06 | — | — | EP | disclosed |
| WO-2021063207-A1 | JNK INHIBITOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | 武汉朗来科技发展有限公司 | 2021-04-08 | — | — | WO | disclosed |