Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.34 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5089674 | 0.85 | CDK1 (0.48) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL27253612 | 0.77 | CDK1 (0.49) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL27538053 | 0.74 | GSK3B (0.56) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL27559817 | 0.73 | IDO1 (0.55) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL5089665 | 0.73 | CDK1 (0.51) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL5089661 | 0.72 | GSK3B (0.60) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL5099510 | 0.71 | CNR1 (0.51) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL29367195 | 0.71 | IDO1 (0.50) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL7148319 | 0.70 | GSK3B (0.50) | CDK1GSK3AGSK3BIDO1CNR1 | |
| SCHEMBL802729 | 0.67 | CDK1 (0.47) | CDK1GSK3AGSK3BIDO1CNR1 |
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-1317433-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002020495-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2002-03-14 | — | — | WO | disclosed |