Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | GSK3A | P49840 | 3/20 | 0.41 |
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 2/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL2912015 | 0.94 | GSK3B (0.42) | GSK3BGSK3ACDK1HSD11B1CCNB2 | |
| Ammonia Solution, Strong SCHEMBL2906802 | 0.93 | GSK3B (0.41) | GSK3BGSK3ACDK1HSD11B1CCNB2 | |
| Ammonia Solution, Strong SCHEMBL2912932 | 0.83 | SMN1; SMN2 (0.47) | GSK3BGSK3ATSHRLMNAALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL2912310 | 0.78 | HRH3 (0.41) | GSK3BGSK3ADPP4 | |
| SCHEMBL6028956 | 0.75 | GSK3B (0.38) | GSK3BGSK3ACDK1HSD11B1CCNB2 | |
| Ammonia Solution, Strong SCHEMBL2908714 | 0.74 | SMN1; SMN2 (0.42) | GSK3BGSK3ALMNAALDH1A1DPP4 | |
| SCHEMBL1219415 | 0.73 | GSK3B (0.51) | GSK3BGSK3ACDK1HSD11B1CCNB2 | |
| SCHEMBL2910561 | 0.73 | GSK3B (0.51) | GSK3BGSK3ACDK1HSD11B1CCNB2 | |
| SCHEMBL2912175 | 0.72 | GSK3B (0.51) | GSK3BGSK3ACDK1HSD11B1CCNB2 | |
| SCHEMBL2911945 | 0.72 | HSD11B1 (0.47) | HSD11B1MAPK1LMNAPOLBALDH1A1 |
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-1537099-B1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2010-08-11 | — | — | EP | disclosed |