Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL13681899 | 0.77 | OPRM1 (0.39) | CYP2D6ACHECYP1A2NOTUM | |
| SCHEMBL2089551 | 0.77 | OPRM1 (0.39) | CYP2D6ACHECYP1A2NOTUM | |
| SCHEMBL32677131 | 0.76 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL32677026 | 0.76 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL32676785 | 0.76 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL32677197 | 0.74 | ADRA2A (0.40) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL32677206 | 0.74 | ADRA2A (0.40) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL32676801 | 0.74 | ADRA2A (0.40) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL23856659 | 0.70 | HTR1A (0.38) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D | |
| SCHEMBL30046702 | 0.70 | HTR1A (0.38) | ADRA2AADRA2BADRA2CCYP2D6ADRA1D |
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-109476663-A | PYRAZOLOPYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER | 基因泰克公司 | 2019-03-15 | — | — | CN | disclosed |