Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN5A | Q14524 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.40 |
| ▸ | DAGLB | Q8NCG7 | 2/20 | 0.40 |
| ▸ | DAGLA | Q9Y4D2 | 2/20 | 0.40 |
| ▸ | FLT1 | P17948 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DDHD2 | O94830 | 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 | |
|---|---|---|---|---|
| SCHEMBL28128023 | 0.81 | GAA (0.51) | SCN5AALDH1A1KDM4ENPC1GAA | |
| SCHEMBL13739677 | 0.78 | CA12 (0.42) | GAAMAPTCA12CA1CA2 | |
| SCHEMBL21321921 | 0.76 | GAA (0.42) | ALDH1A1NPC1GAAMAPTRAB9A | |
| SCHEMBL26316512 | 0.73 | ALDH1A1 (0.39) | ALDH1A1KDM4ENPC1GAAMAPT | |
| SCHEMBL253692 | 0.73 | SCN5A (0.56) | SCN5A | |
| SCHEMBL28148738 | 0.73 | CA12 (0.54) | ALDH1A1GAAMAPTCA12CA1 | |
| SCHEMBL9425491 | 0.73 | TSHR (0.49) | ALDH1A1SLC6A4SLC6A3TSHR | |
| SCHEMBL8990621 | 0.73 | TSHR (0.49) | ALDH1A1SLC6A4SLC6A3TSHR | |
| SCHEMBL9060389 | 0.73 | TSHR (0.49) | ALDH1A1SLC6A4SLC6A3TSHR | |
| SCHEMBL8990856 | 0.73 | TSHR (0.49) | ALDH1A1SLC6A4SLC6A3TSHR |
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-2707361-A1 | FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS | Gilead Sciences, Inc. (US) | 2014-03-19 | — | — | EP | claimed |
| WO-2012154760-A1 | FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS | GILEAD SCIENCES, INC. (US) | 2012-11-15 | — | — | WO | claimed |