Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 3/20 | 0.44 |
| ▸ | ULK1 | O75385 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 2/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | GLI1 | P08151 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | CTSC | P53634 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.36 |
| ▸ | SCN4A | P35499 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19815952 | 1.00 | PRCP (0.44) | PRCPULK1NOS2NOS3NOS1 | |
| SCHEMBL5599650 | 0.94 | — | — | |
| SCHEMBL5599647 | 0.94 | — | — | |
| SCHEMBL4592313 | 0.94 | — | — | |
| SCHEMBL15962430 | 0.83 | PRCP (0.46) | PRCPULK1NOS2NOS3NOS1 | |
| Tert-Butyl Formate SCHEMBL28092130 | 0.82 | SCN9A (0.37) | PRCPULK1HTR2CHTR2BHDAC2 | |
| SCHEMBL3806378 | 0.81 | HDAC8 (0.46) | PRCPULK1NOS2NOS3NOS1 | |
| SCHEMBL19815565 | 0.81 | HDAC8 (0.46) | PRCPULK1NOS2NOS3NOS1 | |
| SCHEMBL29572383 | 0.81 | HDAC8 (0.46) | PRCPULK1NOS2NOS3NOS1 | |
| SCHEMBL13306379 | 0.79 | PRCP (0.47) | PRCPULK1NOS2NOS3NOS1 |
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-105873930-B | Novel bicyclic compounds and their use as antibacterial agents and β -lactamase inhibitors | 费多拉制药公司 | 2019-02-19 | — | — | CN | disclosed |