Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | FYN | P06241 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | SYK | P43405 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.35 |
| ▸ | CBFB | Q13951 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18800558 | 0.89 | BTK (0.43) | BTKTP53SYKALDH1A1KDM4E | |
| SCHEMBL18800468 | 0.87 | BTK (0.49) | ADORA1BTKMAPTFYNALDH1A1 | |
| SCHEMBL18800792 | 0.85 | BTK (0.47) | ADORA1BTKGAAMAPTBRD4 | |
| SCHEMBL18800891 | 0.84 | BTK (0.62) | ADORA1BTKMAPTTP53SYK | |
| SCHEMBL18800784 | 0.83 | BTK (0.46) | ADORA1BTK | |
| SCHEMBL18800884 | 0.83 | BTK (0.42) | BTKTP53AURKASYKLMNA | |
| SCHEMBL18800559 | 0.81 | BTK (0.58) | BTKMAPTTP53ALDH1A1SRC | |
| SCHEMBL18800885 | 0.80 | BTK (0.48) | BTKKDRALDH1A1LCKSRC | |
| SCHEMBL18800886 | 0.77 | BTK (0.42) | BTKLMNAALOX15HSD17B10 | |
| SCHEMBL18800466 | 0.77 | DHODH (0.42) | ADORA1BTKMAPTFYNKDR |
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-B1 | Azaindazoles as Btk kinase modulators and use thereof | BRISTOL MYERS SQUIBB CO (US) | 2017-05-03 | — | — | EP | disclosed |