Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 5/20 | 0.38 |
| ▸ | PARP11 | Q9NR21 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.34 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1432600 | 0.79 | PARP10 (0.63) | PARP10PARP11PARP1GRM5 | |
| SCHEMBL13186574 | 0.77 | PARP10 (0.47) | PARP10PARP11PARP1GRM5 | |
| SCHEMBL8526314 | 0.74 | DRD2 (0.53) | ALDH1A1GAAADRA2AADRA2BADRA2C | |
| SCHEMBL13186597 | 0.72 | NPC1 (0.51) | PARP10PARP11MEN1KMT2AMAPT | |
| SCHEMBL5871312 | 0.70 | GFER (0.43) | PARP10ALDH1A1GAAADRA2AADRA2B | |
| SCHEMBL2577433 | 0.68 | HTR2C (0.53) | ADRA2AADRA2BADRA2C | |
| SCHEMBL8155747 | 0.68 | PARP11 (0.68) | PARP10PARP11PARP1GRM5 | |
| SCHEMBL6776955 | 0.67 | CASP1 (0.53) | ALDH1A1CYP26A1MIFKDM4EHSD17B10 | |
| SCHEMBL4886295 | 0.67 | ALDH1A1 (0.46) | ALDH1A1KDM4EALOX15HSD17B10LMNA | |
| SCHEMBL3873373 | 0.66 | PNMT (0.55) | ADRA2AADRA2BADRA2C |
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-2010100070-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-10 | — | — | WO | disclosed |