Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 5/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.39 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5227096 | 0.92 | SMO (0.44) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL5228292 | 0.84 | SMO (0.37) | SMO | |
| SCHEMBL2761237 | 0.83 | SMO (0.43) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL1998311 | 0.83 | SMO (0.60) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL5224670 | 0.82 | NR3C1 (0.35) | SMOLMNAALDH1A1MAPK1NPSR1 | |
| Hydrochloric Acid SCHEMBL1997589 | 0.82 | SMO (0.42) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL5229176 | 0.82 | SMO (0.39) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL5223624 | 0.79 | SMO (0.41) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL2006337 | 0.77 | SMO (0.40) | SMODRD2DRD4DRD3MAPT | |
| SCHEMBL5227445 | 0.76 | DRD4 (0.46) | SMODRD2DRD4DRD3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |