Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.35 |
| ▸ | CLK1 | P49759 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | GCGR | P47871 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL432713 | 0.86 | TTR (0.44) | GRM2KDM4EESR1ESR2HPGD | |
| SCHEMBL17514779 | 0.86 | NISCH (0.38) | NISCHHSD11B1GRM2CLK1FASN | |
| SCHEMBL5868334 | 0.83 | HSD11B1 (0.41) | NISCHHSD11B1GRM2CLK1FASN | |
| SCHEMBL2052439 | 0.82 | GRM5 (0.33) | KDM4EGRM5HPGDMEN1USP2 | |
| SCHEMBL432623 | 0.81 | AHR (0.52) | HSD11B1NPC1RAB9AKDM4ETP53 | |
| SCHEMBL17514743 | 0.79 | NISCH (0.41) | NISCHHSD11B1GRM2CLK1FASN | |
| SCHEMBL3543657 | 0.79 | NISCH (0.45) | NISCHHSD11B1GRM2CLK1FASN | |
| SCHEMBL15637743 | 0.79 | ABL1 (0.37) | GRM5HPGDALDH1A1 | |
| SCHEMBL17514797 | 0.79 | HSD11B1 (0.35) | NISCHHSD11B1MAPK14ROS1 | |
| SCHEMBL2430752 | 0.77 | TXN (0.34) | NPC1RAB9ATP53SMN1; SMN2ESR2 |
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 |