Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 4/20 | 0.40 |
| ▸ | GSK3A | P49840 | 3/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2904193 | 1.00 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2911588 | 0.93 | ALDH1A1 (0.34) | SMN1; SMN2ALDH1A1GSK3BGSK3ALMNA | |
| SCHEMBL2911036 | 0.93 | ALDH1A1 (0.34) | SMN1; SMN2ALDH1A1GSK3BGSK3ALMNA | |
| SCHEMBL2907242 | 0.92 | LMNA (0.34) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2938731 | 0.92 | MET (0.34) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2908179 | 0.92 | MET (0.34) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2904632 | 0.92 | LMNA (0.34) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2911017 | 0.92 | GSK3B (0.33) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2911391 | 0.92 | GSK3B (0.33) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 | |
| SCHEMBL2910075 | 0.91 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1GSK3BGSK3ACDK1 |
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 |