Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 13/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.39 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.39 |
| ▸ | CCR6 | P51684 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17159520 | 1.00 | ABL1 (0.41) | ABL1KCNH2SCN5ASCN10ASCN1A | |
| SCHEMBL17171864 | 0.87 | KCNH2 (0.42) | ABL1KCNH2SCN10A | |
| SCHEMBL17157449 | 0.86 | CYP3A4 (0.43) | ABL1KCNH2SCN5ASCN10ASCN1A | |
| SCHEMBL17171913 | 0.85 | CYP3A4 (0.45) | ABL1KCNH2CCR6CYP19A1KIF11 | |
| SCHEMBL17171867 | 0.84 | CYP19A1 (0.50) | CYP19A1 | |
| SCHEMBL17171872 | 0.84 | ABL1 (0.45) | ABL1KCNH2SCN5ASCN10ACCR6 | |
| SCHEMBL17171892 | 0.84 | ABL1 (0.41) | ABL1KCNH2SCN5ASCN10ACCR6 | |
| SCHEMBL17159528 | 0.84 | SCN5A (0.43) | ABL1KCNH2SCN5ASCN10ACCR6 | |
| SCHEMBL17171861 | 0.84 | CYP19A1 (0.54) | CYP19A1KIF11 | |
| SCHEMBL17172261 | 0.83 | ABL1 (0.45) | ABL1KCNH2SCN5ASCN10ASCN1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3131400-A1 | METALLOENZYME INHIBITOR COMPOUNDS AS FUNGICIDES | Dow AgroSciences LLC (US) | 2017-02-22 | — | — | EP | disclosed |
| WO-2015160664-A1 | METALLOENZYME INHIBITOR COMPOUNDS AS FUNGICIDES | DOW AGROSCIENCES LLC (US) | 2015-10-22 | — | — | WO | disclosed |