Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 8/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 8/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.36 |
| ▸ | CDK2 | P24941 | 5/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8487263 | 1.00 | CDK5 (0.36) | CDK5CDK5R1CCNA2CDK2HSP90AA1 | |
| SCHEMBL8471697 | 0.74 | HSP90AA1 (0.37) | CDK5CDK5R1CCNA2CDK2HSP90AA1 | |
| SCHEMBL8766688 | 0.70 | DRD1 (0.34) | — | |
| SCHEMBL8475275 | 0.69 | HSP90AA1 (0.33) | CDK5CDK5R1HSP90AA1 | |
| SCHEMBL987864 | 0.62 | HSP90AA1 (0.50) | HSP90AA1 | |
| SCHEMBL987357 | 0.61 | HSP90AA1 (0.47) | HSP90AA1 | |
| SCHEMBL13865788 | 0.60 | CDK5 (0.51) | CDK5CDK5R1CCNA2CDK2HSP90AA1 | |
| SCHEMBL601423 | 0.60 | NOS3 (0.47) | CDK5CDK5R1CCNA2CDK2HSP90AA1 | |
| SCHEMBL19498164 | 0.60 | HSP90AA1 (0.44) | CDK5CDK2HSP90AA1CDK1 | |
| SCHEMBL8487015 | 0.60 | IRAK4 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5889012-A | INSECTICIDE, ACARICIDES, FUNGICIDES | HOECHST-SCHERING AGREVO GMBH (DE) | 1999-03-30 | — | — | US | disclosed |