Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.44 |
| ▸ | CDK7 | P50613 | 1/20 | 0.43 |
| ▸ | CDK9 | P50750 | 1/20 | 0.43 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.42 |
| ▸ | FEN1 | P39748 | 2/20 | 0.42 |
| ▸ | ALK | Q9UM73 | 9/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.38 |
| ▸ | P2RX2 | Q9UBL9 | 3/20 | 0.38 |
| ▸ | INSR | P06213 | 6/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.37 |
| ▸ | TTK | P33981 | 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 | |
|---|---|---|---|---|
| SCHEMBL27994134 | 0.84 | ATR (0.47) | ATRCDK9ALOX5APFEN1 | |
| Hydrogen Peroxide SCHEMBL28006776 | 0.82 | ATR (0.48) | ATRCDK9ALOX5APFEN1ALK | |
| SCHEMBL21358240 | 0.82 | ATR (0.46) | ATRCDK7CDK9ALOX5APFEN1 | |
| SCHEMBL28062139 | 0.79 | ALOX5AP (0.42) | ATRCDK7CDK9ALOX5APFEN1 | |
| SCHEMBL28012316 | 0.78 | ATR (0.47) | ATRCDK7CDK9ALOX5APFEN1 | |
| SCHEMBL26627842 | 0.78 | P2RX3 (0.51) | P2RX3P2RX2 | |
| SCHEMBL30462096 | 0.78 | P2RX3 (0.51) | P2RX3P2RX2 | |
| SCHEMBL28024852 | 0.75 | ALOX5AP (0.46) | ATRCDK7CDK9ALOX5APFEN1 | |
| SCHEMBL28104154 | 0.75 | ALOX5AP (0.44) | ATRCDK7CDK9ALOX5APFEN1 | |
| SCHEMBL2315427 | 0.74 | ALOX5AP (0.44) | ATRCDK7CDK9ALOX5APFEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104672214-A | Compound with ALK inhibition activity as well as preparation method and use of compound | SHANGHAI HANSOH BIOMEDICAL CO LTD | 2015-06-03 | — | — | CN | disclosed |