Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.50 |
| ▸ | TDP2 | O95551 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | AKT1 | P31749 | 2/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | GRIA1 | P42261 | 4/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | ULK1 | O75385 | 1/20 | 0.38 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.37 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25079861 | 0.88 | CCR6 (0.48) | KIF11CDK2AKT1CDK1KIT | |
| SCHEMBL25079568 | 0.82 | GAA (0.60) | KIF11GAACDK2SMYD3 | |
| SCHEMBL30284876 | 0.82 | GAA (0.60) | KIF11GAACDK2SMYD3 | |
| SCHEMBL25079839 | 0.81 | CCR6 (0.48) | CDK2 | |
| SCHEMBL25079308 | 0.79 | CRBN (0.45) | CDK2AKT1CDK1KITKDR | |
| SCHEMBL1903306 | 0.77 | KIF11 (0.80) | KIF11TDP2PDE3BPDE3AGAA | |
| SCHEMBL25079859 | 0.77 | CCR6 (0.46) | CDK2 | |
| SCHEMBL25079792 | 0.77 | CCR6 (0.47) | CDK2KDRMET | |
| SCHEMBL25079539 | 0.76 | CCR6 (0.47) | CDK2 | |
| SCHEMBL25079808 | 0.76 | CCR6 (0.47) | CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023023534-A2 | ARYL SULFONYL COMPOUNDS AS CCR6 INHIBITORS | CHEMOCENTRYX, INC. (US) | 2023-02-23 | — | — | WO | disclosed |