Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.64 |
| ▸ | HTR6 | P50406 | 1/20 | 0.53 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.50 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | GABRP | O00591 | 1/20 | 0.44 |
| ▸ | GABRD | O14764 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.44 |
| ▸ | GABRE | P78334 | 1/20 | 0.44 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.44 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.44 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.44 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28470040 | 0.92 | SCN9A (0.71) | SCN9AHTR6PDK4JAK1GABRP | |
| SCHEMBL14540703 | 0.83 | HTR6 (0.70) | SCN9AHTR6PDK4JAK1GRM1 | |
| SCHEMBL17495453 | 0.82 | SCN9A (0.56) | SCN9AHTR6PDK4JAK1GABRP | |
| SCHEMBL31700764 | 0.82 | PDK4 (0.53) | SCN9AHTR6PDK4JAK1GABRP | |
| SCHEMBL1764181 | 0.81 | PDK4 (0.53) | SCN9AHTR6PDK4JAK1GRM1 | |
| SCHEMBL1038502 | 0.81 | PDK4 (0.52) | SCN9AHTR6PDK4JAK1GRM1 | |
| SCHEMBL2264033 | 0.81 | GABRP (0.60) | SCN9APDK4JAK1GABRPGABRD | |
| SCHEMBL19107666 | 0.80 | PDK4 (0.51) | SCN9AHTR6PDK4JAK1GRM1 | |
| SCHEMBL21138144 | 0.80 | CNR1 (0.59) | SCN9AHTR6PDK4JAK1GABRP | |
| SCHEMBL19284582 | 0.80 | PDK4 (0.56) | SCN9AHTR6PDK4JAK1GRM1 |
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-2019204505-A2 | K-RAS MODULATORS WITH A VINYL SULFONAMIDE MOIETY | THERAS, INC. (US) | 2019-10-24 | — | — | WO | disclosed |
| WO-2019204505-A2 | K-RAS MODULATORS WITH A VINYL SULFONAMIDE MOIETY | THERAS, INC. (US) | 2019-10-24 | — | — | WO | disclosed |