Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 4/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5225265 | 0.93 | SMO (0.59) | SMOLMNAMAPTL3MBTL1NR3C1 | |
| SCHEMBL5229662 | 0.92 | SMO (0.58) | SMOLMNAMAPTL3MBTL1NR3C1 | |
| SCHEMBL5225922 | 0.89 | L3MBTL1 (0.53) | SMOLMNAMAPTL3MBTL1PIK3CG | |
| SCHEMBL5230174 | 0.86 | DRD4 (0.46) | SMOMAPTL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL5225751 | 0.86 | SMO (0.54) | SMOLMNAMAPTL3MBTL1NR3C1 | |
| SCHEMBL5227214 | 0.84 | SMO (0.52) | SMOLMNANR3C1KDM4EALDH1A1 | |
| SCHEMBL2761123 | 0.82 | SMO (0.50) | SMOLMNAMAPTL3MBTL1KDM4E | |
| SCHEMBL5228219 | 0.82 | SMO (0.47) | SMOLMNAMAPTL3MBTL1ALDH1A1 | |
| SCHEMBL5228124 | 0.81 | SMO (0.43) | SMOLMNAMAPTL3MBTL1MAPK14 | |
| SCHEMBL5228140 | 0.79 | NR3C1 (0.48) | SMOLMNAMAPTNR3C1KMT2A |
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 |