Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 11/20 | 0.39 |
| ▸ | LPL | P06858 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | MLNR | O43193 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24255786 | 0.95 | LPL (0.38) | PDK2LPLLIPGSLC6A2SLC6A4 | |
| SCHEMBL17243435 | 0.95 | PDK2 (0.37) | PDK2LPLLIPGSLC6A2SLC6A4 | |
| SCHEMBL23950902 | 0.95 | PDK2 (0.40) | PDK2LPLLIPGESR1ESR2 | |
| SCHEMBL21203337 | 0.95 | PDK2 (0.40) | PDK2LPLLIPGESR1ESR2 | |
| SCHEMBL14340230 | 0.94 | PDK2 (0.42) | PDK2MLNRNR1I2CHRM2ADRB1 | |
| SCHEMBL15081557 | 0.94 | PDK2 (0.35) | PDK2LPLLIPGSLC6A2SLC6A4 | |
| SCHEMBL17243528 | 0.94 | PDK2 (0.37) | PDK2LPLLIPGSLC6A2SLC6A4 | |
| SCHEMBL21203708 | 0.94 | PDK2 (0.37) | PDK2LPLLIPGSLC6A2SLC6A4 | |
| SCHEMBL17243446 | 0.94 | PDK2 (0.37) | PDK2LPLLIPGSLC6A2SLC6A4 | |
| SCHEMBL17243506 | 0.94 | PDK2 (0.37) | PDK2LPLLIPGSLC6A2SLC6A4 |
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-2021143222-A1 | HIGH-PERFORMANCE HOLE TRANSPORT MATERIAL, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 华南理工大学 | 2021-07-22 | — | — | WO | disclosed |