Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 6/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 2/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | ABL2 | P42684 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8402235 | 0.89 | BTK (0.75) | BTKADORA2AADORA1CLK1CDK5 | |
| SCHEMBL6115784 | 0.78 | BTK (0.81) | BTKADORA2AADORA1CYP1A2CYP3A4 | |
| SCHEMBL6115583 | 0.74 | BTK (1.00) | BTKADORA2AADORA1CYP1A2CYP3A4 | |
| SCHEMBL18800760 | 0.74 | BTK (0.61) | BTKADORA2AADORA1PDGFRBCLK1 | |
| SCHEMBL1162774 | 0.73 | BTK (1.00) | BTKADORA2AADORA1CLK1CYP1A2 | |
| SCHEMBL8402322 | 0.72 | BTK (0.71) | BTKADORA2AADORA1CLK1CDK5 | |
| SCHEMBL8402333 | 0.70 | BTK (0.74) | BTKADORA2AADORA1CYP1A2CYP3A4 | |
| SCHEMBL1163102 | 0.69 | BTK (0.77) | BTKADORA2AADORA1CYP1A2CYP3A4 | |
| SCHEMBL6115895 | 0.69 | BTK (0.78) | BTKPDGFRBDHODHMAPT | |
| SCHEMBL6116666 | 0.68 | ADORA2A (0.47) | BTKADORA2AADORA1CLK1CDK5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2789615-A1 | Azaindazoles as Btk kinase modulators and use thereof | Bristol-Myers Squibb Company (US) | 2014-10-15 | — | — | EP | claimed |