Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 3/20 | 0.34 |
| ▸ | BUB1 | O43683 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | ATR | Q13535 | 1/20 | 0.30 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL7435254 | 0.88 | GSK3A (0.33) | GSK3ABUB1MAPTGSK3BATR | |
| SCHEMBL7433514 | 0.82 | PIM1 (0.36) | GSK3ABUB1MAPTGSK3BATR | |
| SCHEMBL6093719 | 0.82 | SGMS2 (0.37) | GSK3ABUB1MAPTGSK3B | |
| Hydrochloric Acid SCHEMBL6094797 | 0.81 | SGMS2 (0.36) | GSK3ABUB1MAPTGSK3B | |
| SCHEMBL6092102 | 0.80 | SGMS2 (0.37) | GSK3AMAPTGSK3B | |
| Hydrochloric Acid SCHEMBL6093849 | 0.80 | SGMS2 (0.36) | GSK3AMAPTGSK3B | |
| SCHEMBL7439920 | 0.79 | PIM3 (0.33) | BUB1MAPTGSK3B | |
| SCHEMBL7392028 | 0.79 | GSK3B (0.45) | GSK3ABUB1MAPTGSK3BATR | |
| SCHEMBL6094182 | 0.79 | BUB1 (0.35) | GSK3ABUB1MAPTGSK3BATR | |
| SCHEMBL7392263 | 0.78 | GSK3B (0.46) | GSK3ABUB1MAPTGSK3BATR |
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-1210328-A1 | FUSED PYRROLECARBOXAMIDES: A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001016103-A1 | FUSED PYRROLECARBOXAMIDES: GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 2001-03-08 | — | — | WO | disclosed |