Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 3/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 4/20 | 0.43 |
| ▸ | ATAD2 | Q6PL18 | 4/20 | 0.43 |
| ▸ | AR | P10275 | 4/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.42 |
| ▸ | AXL | P30530 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8264491 | 0.85 | AR (0.51) | ITKARKIF11 | |
| SCHEMBL4300332 | 0.83 | ITK (0.47) | ITKPARP14BRD4ATAD2AR | |
| SCHEMBL1049975 | 0.81 | BRD4 (0.46) | ITKCHEK1BRD4ATAD2 | |
| SCHEMBL1199874 | 0.76 | KIF11 (0.46) | ARKIF11 | |
| SCHEMBL23360040 | 0.76 | HTR6 (0.51) | ITKBRD4ATAD2 | |
| SCHEMBL21460268 | 0.76 | HTR6 (0.51) | ITKBRD4ATAD2 | |
| SCHEMBL29862859 | 0.76 | HTR6 (0.51) | ITKBRD4ATAD2 | |
| SCHEMBL21460280 | 0.74 | ITK (0.42) | ITKPARP14BRD4ATAD2PRKCQ | |
| SCHEMBL21460246 | 0.74 | PDK2 (0.43) | ITKCHEK1PARP14PRKCQAXL | |
| SCHEMBL4292261 | 0.73 | PRKCQ (0.41) | ITKCHEK1PARP14BRD4ATAD2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5723627-A | BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-03-03 | — | — | US | disclosed |
| US-5648493-A | MULTISTAGE PROCESS BY CONDENSING AN OXO COMPOUND WITH AN AMINO COMPOUND TO PRODUCE AN IMINE THEN REACTING WITH AN OXO QUINOLINE CARBOXYLIC ACID | BAYER AKTIENGESELLSCHAFT (DE) | 1997-07-15 | — | — | US | disclosed |
| US-5061712-A | BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1991-10-29 | — | — | US | disclosed |