Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 12/20 | 0.58 |
| ▸ | GSK3B | P49841 | 14/20 | 0.56 |
| ▸ | CCNB2 | O95067 | 11/20 | 0.56 |
| ▸ | CCNB1 | P14635 | 11/20 | 0.56 |
| ▸ | CCNB3 | Q8WWL7 | 11/20 | 0.56 |
| ▸ | CDK5 | Q00535 | 5/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 5/20 | 0.53 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.48 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 3/20 | 0.42 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5801923 | 0.85 | CDK1 (0.79) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5815923 | 0.84 | CDK1 (0.56) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5802551 | 0.83 | CDK1 (0.51) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5801910 | 0.82 | CDK1 (0.66) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5802955 | 0.82 | CDK1 (0.53) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5688713 | 0.74 | CDK1 (1.00) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5688439 | 0.71 | GSK3B (1.00) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL30319745 | 0.71 | GSK3B (1.00) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL6012263 | 0.71 | GSK3B (1.00) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5690667 | 0.71 | GSK3B (0.78) | CDK1GSK3BCCNB2CCNB1CCNB3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006089874-A1 | BENZO[2,3]AZEPINO[4,5-B]INDOL-6-ONES | GPC BIOTECH AG (DE) | 2006-08-31 | — | — | WO | disclosed |