Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 11/20 | 0.74 |
| ▸ | HTR1A | P08908 | 4/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 6/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Fenoxazoline SCHEMBL193061 | 0.86 | NISCH (1.00) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Fenoxazoline SCHEMBL317133 | 0.85 | NISCH (0.97) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Fenoxazoline SCHEMBL1650113 | 0.85 | NISCH (0.97) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Tymazoline SCHEMBL28142132 | 0.78 | NISCH (0.81) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Tymazoline SCHEMBL250491 | 0.71 | NISCH (0.70) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Tymazoline SCHEMBL29387735 | 0.71 | NISCH (0.70) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Tymazoline SCHEMBL4415590 | 0.70 | NISCH (0.68) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| SCHEMBL3168567 | 0.70 | NISCH (0.73) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| Metizoline SCHEMBL28086428 | 0.69 | CYP2D6 (0.71) | NISCHHTR1AADRA2AADRA2BADRA2C | |
| SCHEMBL3163867 | 0.68 | NISCH (0.58) | NISCHHTR1AADRA2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| CN-103717597-B | Heterocyclic compounds as kinase inhibitors | 原真股份有限公司 | 2017-07-04 | — | — | CN | disclosed |
| CN-103492389-B | Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases | 原真股份有限公司 | 2016-09-14 | — | — | CN | disclosed |