Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 2/20 | 0.30 |
| ▸ | GSK3B | P49841 | 2/20 | 0.30 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.30 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.30 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6211337 | 0.85 | GSK3A (0.33) | MAPK1GSK3AGSK3BCCNB2CDK1 | |
| SCHEMBL2911941 | 0.82 | HDAC1 (0.34) | ALDH1A1MAPK1KMT2AHDAC1GSK3A | |
| SCHEMBL2909547 | 0.80 | GSK3B (0.37) | GSK3AGSK3BCCNB2CDK1CCNB1 | |
| Hydrochloric Acid SCHEMBL2911853 | 0.80 | KAT2B (0.37) | GSK3AGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL6270770 | 0.78 | BCL2 (0.34) | — | |
| SCHEMBL2912926 | 0.72 | BDKRB1 (0.34) | KMT2AGSK3AGSK3B | |
| SCHEMBL2905411 | 0.69 | GSK3B (0.35) | GSK3AGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL2907410 | 0.69 | GSK3B (0.34) | ALDH1A1MAPK1KMT2AGSK3AGSK3B | |
| SCHEMBL2912527 | 0.69 | GSK3B (0.36) | KMT2AGSK3AGSK3BCDK1 | |
| SCHEMBL2908407 | 0.68 | GSK3B (0.34) | GSK3AGSK3BCDK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1537099-A1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004018455-A1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2004-03-04 | — | — | WO | disclosed |