Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | SMO | Q99835 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 3/20 | 0.37 |
| ▸ | FLT1 | P17948 | 2/20 | 0.37 |
| ▸ | FLT4 | P35916 | 2/20 | 0.37 |
| ▸ | STAT1 | P42224 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | TEK | Q02763 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1689504 | 0.90 | SMO (0.45) | DRD4DRD3SMODRD2KDR | |
| SCHEMBL5738329 | 0.90 | CYP2A13 (0.43) | DRD4DRD3SMODRD2KDR | |
| SCHEMBL5228638 | 0.89 | DRD4 (0.41) | DRD4DRD3SMODRD2STAT1 | |
| SCHEMBL5737789 | 0.89 | SMO (0.44) | DRD4DRD3SMODRD2SSTR5 | |
| SCHEMBL7256544 | 0.89 | DRD4 (0.44) | DRD4DRD3SMODRD2SSTR5 | |
| SCHEMBL5226383 | 0.87 | DRD3 (0.44) | DRD4DRD3SMODRD2KDR | |
| SCHEMBL7261049 | 0.86 | CHKA (0.50) | DRD4DRD3SMODRD2KDR | |
| SCHEMBL5227503 | 0.85 | DRD4 (0.42) | DRD4DRD3SMODRD2KDR | |
| SCHEMBL5226795 | 0.85 | SMO (0.42) | DRD4DRD3SMODRD2KDR | |
| SCHEMBL5224217 | 0.85 | SMO (0.44) | DRD4DRD3SMODRD2SSTR5 |
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-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |
| WO-2003031435-A1 | PYRAZOLE DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS | MERCK PATENT GMBH (DE) | 2003-04-17 | — | — | WO | disclosed |