Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 5/20 | 0.36 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.36 |
| ▸ | BUB1 | O43683 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 8/20 | 0.34 |
| ▸ | GSK3A | P49840 | 2/20 | 0.34 |
| ▸ | ATR | Q13535 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7435249 | 0.87 | BUB1 (0.35) | PIM1PIM3PIM2BUB1GSK3B | |
| SCHEMBL6093719 | 0.85 | SGMS2 (0.37) | BUB1GSK3BGSK3AMAPT | |
| Hydrochloric Acid SCHEMBL6094797 | 0.85 | SGMS2 (0.36) | PIM1PIM3PIM2BUB1GSK3B | |
| SCHEMBL6092102 | 0.84 | SGMS2 (0.37) | GSK3BGSK3AMAPT | |
| SCHEMBL6094182 | 0.84 | BUB1 (0.35) | PIM1PIM3PIM2BUB1GSK3B | |
| Hydrochloric Acid SCHEMBL6093849 | 0.83 | SGMS2 (0.36) | PIM1PIM3PIM2GSK3BGSK3A | |
| SCHEMBL6093372 | 0.83 | ATR (0.37) | PIM1PIM3PIM2BUB1GSK3B | |
| SCHEMBL6094276 | 0.82 | GSK3B (0.38) | PIM1PIM3PIM2BUB1GSK3B | |
| SCHEMBL7433522 | 0.82 | GSK3A (0.34) | BUB1GSK3BGSK3AATRMAPT | |
| SCHEMBL6094509 | 0.82 | BUB1 (0.39) | PIM1PIM3PIM2BUB1GSK3B |
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 |