Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | IKBKE | Q14164 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1155267 | 0.91 | ALDH1A1 (0.41) | HTR2ADRD2HRH1ALDH1A1ADRA2A | |
| SCHEMBL1155296 | 0.86 | IKBKE (0.39) | HTR2ADRD2HRH1ALDH1A1ADRA2A | |
| SCHEMBL1155272 | 0.85 | ALDH1A1 (0.37) | HTR2ADRD2HRH1ALDH1A1SQOR | |
| SCHEMBL1155211 | 0.85 | ALDH1A1 (0.37) | HTR2ADRD2HRH1ALDH1A1SQOR | |
| SCHEMBL1154973 | 0.85 | ALDH1A1 (0.37) | HTR2ADRD2HRH1ALDH1A1SQOR | |
| SCHEMBL1154756 | 0.84 | IKBKE (0.43) | HTR2ADRD2HRH1ALDH1A1ADRA2A | |
| SCHEMBL1155086 | 0.82 | HTR6 (0.40) | HTR2ADRD2HRH1ALDH1A1ADRA2A | |
| SCHEMBL1154472 | 0.82 | HTR6 (0.40) | HTR2ADRD2HRH1ALDH1A1ADRA2A | |
| SCHEMBL1155061 | 0.82 | HTR6 (0.40) | HTR2ADRD2HRH1ALDH1A1ADRA2A | |
| SCHEMBL1155196 | 0.82 | DRD2 (0.39) | HTR2ADRD2HRH1ALDH1A1ADRA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1765810-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | Decode Chemistry, Inc. (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2005123724-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | DECODE CHEMISTRY, INC. (US) | 2005-12-29 | — | — | WO | disclosed |