Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12932860 | 0.73 | HTR2A (0.53) | LMNAGAAHTR2AALDH1A1MEN1 | |
| SCHEMBL21600902 | 0.71 | ADRB2 (0.42) | ADRB2ADRB1ADRB3KCNH2GAA | |
| SCHEMBL18633517 | 0.71 | PTGS2 (0.41) | GAAALDH1A1MEN1KMT2A | |
| SCHEMBL21345583 | 0.70 | LMNA (0.47) | LMNAKCNH2GAAHTR2AALDH1A1 | |
| SCHEMBL9781364 | 0.70 | MEN1 (0.53) | LMNAGAAALDH1A1MEN1KMT2A | |
| SCHEMBL12309456 | 0.70 | CD274 (0.48) | ADRB2ADRB1ADRB3CD274 | |
| SCHEMBL21280364 | 0.70 | PDE4A (0.43) | GAAALDH1A1MEN1KMT2A | |
| SCHEMBL16246151 | 0.70 | GAA (0.39) | GAAHTR2AALDH1A1MEN1KMT2A | |
| SCHEMBL16200311 | 0.69 | MAPT (0.42) | LMNAGAAALDH1A1MEN1KMT2A | |
| SCHEMBL13178795 | 0.68 | P2RX3 (0.39) | LMNAADRB2ADRB1ADRB3GAA |
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-2019242689-A1 | CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2019-12-26 | — | — | WO | disclosed |