Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 5/20 | 0.35 |
| ▸ | GSK3A | P49840 | 4/20 | 0.35 |
| ▸ | QPCT | Q16769 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 2/20 | 0.32 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.31 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL2904943 | 0.93 | GSK3B (0.35) | GSK3BGSK3ALMNACDK1CCNB2 | |
| SCHEMBL2905411 | 0.92 | GSK3B (0.35) | GSK3BGSK3ACDK1CCNB2CCNB1 | |
| SCHEMBL2910908 | 0.92 | GSK3B (0.41) | GSK3BGSK3AHTTLMNACDK1 | |
| SCHEMBL2904037 | 0.91 | GSK3B (0.34) | METGSK3BGSK3ACDK1AXL | |
| SCHEMBL2910444 | 0.91 | MAPT (0.35) | GSK3BGSK3AHTTLMNACYP1A2 | |
| SCHEMBL2912809 | 0.90 | GSK3B (0.37) | METGSK3BGSK3ACDK1CCNB2 | |
| SCHEMBL2912022 | 0.90 | GSK3B (0.34) | GSK3BGSK3ACDK1AXLMERTK | |
| SCHEMBL2910224 | 0.88 | GSK3B (0.42) | GSK3BGSK3AHTTLMNACDK1 | |
| SCHEMBL2911792 | 0.88 | GSK3B (0.36) | METGSK3BGSK3AQPCTHTT | |
| SCHEMBL2912012 | 0.86 | GSK3A (0.41) | GSK3BGSK3AHTTCDK1MAPK1 |
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 |