Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 8/20 | 0.46 |
| ▸ | PGR | P06401 | 3/20 | 0.43 |
| ▸ | S100A4 | P26447 | 1/20 | 0.39 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | MLNR | O43193 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL19849937 | 0.87 | PDK2 (0.59) | PDK2PGRS100A4AKR1A1AKR1B1 | |
| SCHEMBL22920723 | 0.85 | PDK2 (0.44) | PDK2PGRS100A4AKR1A1AKR1B1 | |
| SCHEMBL26602840 | 0.85 | PGR (0.42) | PDK2PGRAKR1A1AKR1B1NR1I2 | |
| SCHEMBL20806340 | 0.84 | PDK2 (0.56) | PDK2PGRS100A4AKR1A1AKR1B1 | |
| SCHEMBL25818678 | 0.83 | PDK2 (0.35) | PDK2PGR | |
| SCHEMBL31526926 | 0.81 | PTGES (0.39) | PDK2PGR | |
| SCHEMBL23511914 | 0.81 | PGR (0.38) | PDK2PGR | |
| SCHEMBL22920934 | 0.81 | PDK2 (0.43) | PDK2PGRS100A4AKR1A1AKR1B1 | |
| SCHEMBL25818473 | 0.81 | PGR (0.41) | PDK2PGRS100A4AKR1A1AKR1B1 | |
| SCHEMBL24279350 | 0.81 | PGR (0.41) | PDK2PGRS100A4AKR1A1AKR1B1 |
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-2021015555-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT | 덕산네오룩스 주식회사 | 2021-01-28 | — | — | WO | disclosed |