Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 5/20 | 0.35 |
| ▸ | CCND1 | P24385 | 5/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 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 | |
|---|---|---|---|---|
| SCHEMBL15796873 | 0.89 | CDK4 (0.39) | PDK2BCHEHTR7HTR6TNKS2 | |
| SCHEMBL14928323 | 0.88 | ALK (0.33) | PDK2PIM1PIM3ALK | |
| SCHEMBL19195543 | 0.85 | KDM4E (0.35) | ALK | |
| SCHEMBL19196555 | 0.85 | AR (0.48) | PDK2CDK4CCND1GABRA1GABRG2 | |
| SCHEMBL18665883 | 0.84 | CDK4 (0.41) | PDK2HTR7HTR6TNKS2CDK4 | |
| SCHEMBL29819516 | 0.84 | KIF11 (0.47) | BCHEGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL1707718 | 0.84 | KIF11 (0.47) | BCHEGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL15413807 | 0.82 | PGR (0.33) | PDK2 | |
| SCHEMBL17232188 | 0.81 | BCHE (0.36) | BCHEHTR7HTR6CDK4CCND1 | |
| SCHEMBL16688067 | 0.81 | PDK2 (0.39) | PDK2BCHEHTR7HTR6CDK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020032447-A1 | ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2020-02-13 | — | — | WO | disclosed |
| WO-2020032428-A1 | ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT AND ELECTRONIC DEVICE USING SAME | 덕산네오룩스 주식회사 | 2020-02-13 | — | — | WO | disclosed |