Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 9/20 | 0.55 |
| ▸ | CCNB2 | O95067 | 8/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 8/20 | 0.49 |
| ▸ | GSK3B | P49841 | 8/20 | 0.49 |
| ▸ | CCNB3 | Q8WWL7 | 8/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.38 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.38 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5819148 | 0.90 | CDK1 (0.66) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| Hydrochloric Acid SCHEMBL5803457 | 0.89 | CDK1 (0.57) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5801910 | 0.80 | CDK1 (0.66) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5802551 | 0.77 | CDK1 (0.51) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5801919 | 0.75 | CDK1 (0.69) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5802955 | 0.75 | CDK1 (0.53) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5805246 | 0.74 | CDK1 (0.73) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5802549 | 0.73 | CDK1 (0.71) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5802581 | 0.72 | CDK1 (0.69) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL5823198 | 0.72 | CDK1 (0.57) | 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 |