Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 4/20 | 0.41 |
| ▸ | ACHE | P22303 | 4/20 | 0.41 |
| ▸ | BACE1 | P56817 | 4/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | EED | O75530 | 2/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.34 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MLNR | O43193 | 1/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL5226514 | 0.86 | PTGS1 (0.38) | CYP2D6USP2LMNATP53CYP1A2 | |
| SCHEMBL5229163 | 0.84 | USP2 (0.39) | HRH3CYP2D6USP2LMNATP53 | |
| SCHEMBL5228622 | 0.79 | MEN1 (0.46) | CYP2D6CHRM1MEN1TP53CHRM2 | |
| SCHEMBL5225875 | 0.75 | CYP2D6 (0.36) | CYP2D6DRD2DRD4TP53CYP3A4 | |
| SCHEMBL5226789 | 0.74 | ALDH1A1 (0.39) | CYP2D6MEN1LMNATP53CYP3A4 | |
| SCHEMBL5222786 | 0.74 | GRM2 (0.38) | KCNH2HRH3CYP2D6TP53HRH1 | |
| SCHEMBL5224047 | 0.74 | KDM4E (0.45) | CYP2D6LMNATP53CYP3A4MAPT | |
| SCHEMBL2761009 | 0.74 | SMO (0.43) | DRD2DRD4LMNATP53MAPT | |
| SCHEMBL5228002 | 0.73 | TSHR (0.39) | ACHETP53HTR2CHTTKMT2A | |
| SCHEMBL5223970 | 0.73 | ADORA2A (0.40) | KCNH2HRH3DRD2DRD4LMNA |
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 |