Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | FABP4 | P15090 | 1/20 | 0.30 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17514715 | 0.88 | HSD11B1 (0.43) | HSD11B1NISCHGRM2HTR1AHTR7 | |
| SCHEMBL436977 | 0.86 | HSD11B1 (0.43) | HSD11B1NPC1RAB9AHPGDTP53 | |
| SCHEMBL436100 | 0.84 | NFE2L2 (0.36) | NPC1RAB9AHPGDMAPK14NFE2L2 | |
| SCHEMBL17514713 | 0.83 | NISCH (0.37) | HSD11B1NISCHGRM2PDE3BPDE3A | |
| SCHEMBL17514845 | 0.81 | HSD11B1 (0.48) | HSD11B1NISCHHTR1AHTR7 | |
| SCHEMBL434297 | 0.79 | HSD11B1 (0.36) | HSD11B1NISCHMAPK14GAAKMT2A | |
| SCHEMBL17514650 | 0.77 | HSD11B1 (0.43) | HSD11B1NISCHGRM2HTR1AHTR7 | |
| SCHEMBL17514868 | 0.77 | NISCH (0.38) | HSD11B1NISCHGRM2HTR1AHTR7 | |
| SCHEMBL17514776 | 0.77 | HSD11B1 (0.43) | HSD11B1NISCHGRM2HTR1AHTR7 | |
| SCHEMBL433087 | 0.77 | EGLN2 (0.37) | HSD11B1GRM2 |
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-2016026830-A1 | NOVEL FUNGICIDAL PYRAZOLE DERIVATIVES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-02-25 | — | — | WO | disclosed |