Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 2/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7201360 | 1.00 | DRD1 (0.34) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8473216 | 0.76 | JAK2 (0.38) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8484803 | 0.75 | DRD1 (0.38) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8484805 | 0.75 | DRD1 (0.38) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8766688 | 0.74 | DRD1 (0.34) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8369812 | 0.73 | DRD1 (0.33) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8484084 | 0.71 | JAK3 (0.34) | DRD1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL24449391 | 0.66 | HRH1 (0.57) | GRIN2B | |
| SCHEMBL9640926 | 0.66 | HRH1 (0.52) | GRIN2B | |
| SCHEMBL21002844 | 0.66 | KDR (0.36) | JAK3IRAK4KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6596727-B1 | Substituted 4-amino- and 4-alkoxy-cycloalkylpyrimidines, processes for their preparation, and their use as pesticides and fungicides control of pests and as fungicides. | HOECHST AKTIENGESELLSCHAFT (DE) | 2003-07-22 | — | — | US | disclosed |
| US-5571815-A | Substituted pyrimidines, process for their preparation, and their use as pesticides and fungicides | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-11-05 | — | — | US | disclosed |