Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 11/20 | 0.57 |
| ▸ | CCNB2 | O95067 | 10/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 10/20 | 0.49 |
| ▸ | GSK3B | P49841 | 10/20 | 0.49 |
| ▸ | CCNB3 | Q8WWL7 | 10/20 | 0.49 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.46 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.36 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5823198 | 0.91 | CDK1 (0.57) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5806193 | 0.90 | CDK1 (0.56) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5801919 | 0.88 | CDK1 (0.69) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5819011 | 0.86 | CDK1 (0.55) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5803817 | 0.84 | CDK1 (0.64) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5802549 | 0.83 | CDK1 (0.71) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5805683 | 0.81 | CDK1 (0.65) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5819216 | 0.79 | CDK1 (0.47) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5816419 | 0.79 | CDK1 (0.47) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| Hydrochloric Acid SCHEMBL5813979 | 0.78 | CDK1 (0.47) | CDK1CCNB2CCNB1GSK3BCCNB3 |
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 |