Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 8/20 | 0.64 |
| ▸ | GABRA5 | P31644 | 8/20 | 0.64 |
| ▸ | GABRA2 | P47869 | 8/20 | 0.64 |
| ▸ | GABRA3 | P34903 | 7/20 | 0.64 |
| ▸ | GABRG2 | P18507 | 6/20 | 0.64 |
| ▸ | GABRB3 | P28472 | 6/20 | 0.64 |
| ▸ | PDE2A | O00408 | 2/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.52 |
| ▸ | GABRP | O00591 | 1/20 | 0.49 |
| ▸ | GABRD | O14764 | 1/20 | 0.49 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.49 |
| ▸ | ALB | P02768 | 1/20 | 0.49 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | GABRE | P78334 | 1/20 | 0.49 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5034654 | 0.97 | GABRA1 (0.65) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5042562 | 0.91 | GABRA1 (0.78) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5044341 | 0.89 | GABRA1 (0.64) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5034629 | 0.89 | GABRA1 (0.63) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5034691 | 0.89 | GABRA1 (0.63) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL6031148 | 0.89 | PDE2A (0.62) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5038976 | 0.88 | GABRA1 (0.64) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL6031566 | 0.88 | GABRA1 (0.54) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5037427 | 0.88 | PDE2A (0.63) | GABRA1GABRA5GABRA2GABRA3GABRG2 | |
| SCHEMBL5034707 | 0.88 | GABRA1 (0.59) | GABRA1GABRA5GABRA2GABRA3GABRG2 |
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-1548011-A1 | Benzo[1,4]diazepin-2-one derivatives as phosphodiesterase PDE2 inhibitors, preparation and therapeutic use thereof | NEURO3D (FR) | 2005-06-29 | — | — | EP | disclosed |