Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.37 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4235894 | 0.96 | HRH4 (0.35) | HRH4 | |
| SCHEMBL4062007 | 0.88 | HRH4 (0.31) | HRH4 | |
| SCHEMBL4013156 | 0.86 | HRH4 (0.33) | HRH4 | |
| SCHEMBL4239976 | 0.80 | PDE4A (0.39) | HRH4 | |
| SCHEMBL14865178 | 0.77 | PDE4B (0.33) | — | |
| SCHEMBL4052797 | 0.76 | PDE4D (0.38) | — | |
| SCHEMBL4060397 | 0.75 | DDB1 (0.33) | HRH4 | |
| SCHEMBL4018297 | 0.74 | CYP17A1 (0.33) | — | |
| SCHEMBL4061738 | 0.73 | HTR2A (0.31) | — | |
| SCHEMBL4053847 | 0.73 | CCR2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |
| WO-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |