Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL34924 | 0.91 | ESR1 (0.36) | GAA | |
| SCHEMBL14473846 | 0.86 | ESR1 (0.32) | GAA | |
| Carbimide SCHEMBL4253887 | 0.85 | ESR1 (0.33) | GAA | |
| SCHEMBL12050426 | 0.85 | ESR1 (0.33) | GAA | |
| SCHEMBL39076 | 0.85 | HDAC8 (0.43) | GAA | |
| SCHEMBL2494913 | 0.85 | ESR1 (0.33) | GAA | |
| SCHEMBL24833769 | 0.84 | PGK1 (0.32) | GAA | |
| SCHEMBL18126139 | 0.82 | ESR1 (0.32) | GAA | |
| SCHEMBL13703565 | 0.82 | ESR1 (0.32) | GAA | |
| SCHEMBL27653093 | 0.81 | TRPV6 (0.39) | CES2TSHRHTR3EHTR3BHTR3A |
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 |
|---|---|---|---|---|---|---|---|
| US-4143061-A | 3-(α,α-Dimethylbenzyl)urea compounds, compositions, and their use as herbicides | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1979-03-06 | — | — | US | disclosed |