Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL28866207 | 0.87 | SMN1; SMN2 (0.47) | SMN1; SMN2NISCHCACNA2D1PDE10ARAB9A | |
| SCHEMBL28052038 | 0.82 | ADRB2 (0.50) | PDK1CACNA1I | |
| SCHEMBL8522790 | 0.82 | MAP2K4 (0.47) | PDE10APDK1CACNA1I | |
| SCHEMBL10263741 | 0.79 | TDP1 (0.42) | SMN1; SMN2NISCHRAB9ANPC1ALDH1A1 | |
| SCHEMBL18484543 | 0.78 | SMN1; SMN2 (0.49) | SMN1; SMN2NISCHPDE10ARAB9ANPC1 | |
| SCHEMBL12670511 | 0.78 | NISCH (0.46) | NISCHPDK1NOTUM | |
| SCHEMBL21624903 | 0.77 | DGAT1 (0.54) | ALDH1A1GAAPDK1CACNA1ILMNA | |
| SCHEMBL12320567 | 0.75 | MAPK14 (0.44) | — | |
| SCHEMBL29536871 | 0.75 | ABL1 (0.35) | ALDH1A1KDM4EMETAP2PDK1CACNA1I | |
| SCHEMBL15730888 | 0.75 | CCNB2 (0.43) | SMN1; SMN2RAB9ANPC1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105418686-A | Pyrazine phosphorescent iridium complex, preparation method and application thereof | CHINA BEIJING BEIDA JUBANG SCIENCE & TECH CO LTD | 2016-03-23 | — | — | CN | disclosed |