Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
| ▸ | GABRE | P78334 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.39 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.39 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20437476 | 0.87 | PDK4 (0.45) | PDK4JAK1HTR6GABRPGABRD | |
| SCHEMBL22873680 | 0.86 | TNF (0.48) | PDK4JAK1HTR6GABRPGABRD | |
| SCHEMBL21796772 | 0.80 | JAK1 (0.42) | PDK4JAK1HTR6CYP11B2GPR119 | |
| SCHEMBL13671245 | 0.75 | PDK4 (0.48) | PDK4JAK1HTR6GABRPGABRD | |
| SCHEMBL15771353 | 0.74 | GRM1 (0.52) | PDK4JAK1HTR6GRM1GRM5 | |
| SCHEMBL30309943 | 0.74 | GRM1 (0.52) | PDK4JAK1HTR6GRM1GRM5 | |
| SCHEMBL16100540 | 0.74 | NR1H2 (0.52) | PDK4JAK1HTR6GABRPGABRD | |
| SCHEMBL30567480 | 0.74 | NR1H2 (0.52) | PDK4JAK1HTR6GABRPGABRD | |
| SCHEMBL30567483 | 0.74 | NR1H2 (0.52) | PDK4JAK1HTR6GABRPGABRD | |
| SCHEMBL15556671 | 0.74 | PDK4 (0.51) | PDK4JAK1HTR6GABRPGABRD |
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-2018137593-A1 | COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-08-02 | — | — | WO | disclosed |