Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL11870640 | 0.79 | KCNH2 (0.43) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL114811 | 0.78 | SCN5A (0.48) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL5839292 | 0.78 | SCN5A (0.48) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL8294936 | 0.78 | SCN5A (0.58) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL20999929 | 0.78 | ALDH1A1 (0.43) | MAOAMAOBHTTMAPT | |
| SCHEMBL27820554 | 0.76 | SCN5A (0.56) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL813231 | 0.75 | SCN5A (0.43) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL11149393 | 0.74 | ACHE (0.41) | SCN5AMAOAMAOBHTTMAPT | |
| SCHEMBL5839192 | 0.74 | KCNH2 (0.46) | KCNH2SCN5ACACNA1CGABRA1GABRB2 | |
| SCHEMBL11141606 | 0.73 | NLRP3 (0.43) | SCN5ACACNA1CCLCN2ALOX15TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0010673-B1 | SUBSTITUTED N-PROPARGYL ANILINES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES | BAYER AG (DE) | 1982-01-27 | — | — | EP | disclosed |
| EP-0010673-A2 | Substituted N-propargyl anilines, process for their preparation and their use as fungicides | BAYER AG (DE) | 1980-05-14 | — | — | EP | disclosed |
| US-4001325-A | α-Chloroacetanilide selective herbicides | DIAMOND SHAMROCK CORPORATION (US) | 1977-01-04 | — | — | US | disclosed |