Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 2/20 | 0.64 |
| ▸ | GABRA1 | P14867 | 7/20 | 0.58 |
| ▸ | GABRA5 | P31644 | 7/20 | 0.58 |
| ▸ | GABRA2 | P47869 | 7/20 | 0.58 |
| ▸ | GABRG2 | P18507 | 6/20 | 0.58 |
| ▸ | GABRB3 | P28472 | 6/20 | 0.58 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.58 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.58 |
| ▸ | CCKBR | P32239 | 1/20 | 0.58 |
| ▸ | GABRP | O00591 | 1/20 | 0.57 |
| ▸ | GABRD | O14764 | 1/20 | 0.57 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.57 |
| ▸ | ALB | P02768 | 1/20 | 0.57 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.57 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.57 |
| ▸ | GABRE | P78334 | 1/20 | 0.57 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL5042656 | 0.94 | GABRA1 (0.58) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5042664 | 0.93 | GABRA1 (0.65) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5042534 | 0.85 | PDE2A (0.66) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5489045 | 0.85 | GABRA1 (0.70) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5044374 | 0.85 | PDE2A (0.84) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5042437 | 0.84 | GABRA1 (0.60) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5034683 | 0.84 | GABRA1 (0.60) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5038185 | 0.82 | GABRA1 (0.68) | GABRA1GABRA5GABRA2GABRG2GABRB3 | |
| SCHEMBL6455679 | 0.81 | GABRA1 (0.64) | PDE2AGABRA1GABRA5GABRA2GABRG2 | |
| SCHEMBL5037299 | 0.81 | GABRA1 (0.70) | GABRA1GABRA5GABRA2GABRG2GABRB3 |
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-1697332-A1 | BENZO'1,4 ! DIAZEPIN-2-ONE DERIVATIVES AS PHOSPHODIESTERASE PDE2 INHIBITORS, PREPARATION AND THERAPEUTIC USE THEREOF | NEURO3D (FR) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005063723-A1 | BENZO`1,4 ! DIAZEPIN-2-ONE DERIVATIVES AS PHOSPHODIESTERASE PDE2 INHIBITORS, PREPARATION AND THERAPEUTIC USE THEREOF | NEURO3D (FR) | 2005-07-14 | — | — | WO | disclosed |