Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL570453 | 0.97 | ALDH1A1 (0.33) | ALDH1A1TP53TSHR | |
| SCHEMBL28329124 | 0.86 | ALDH1A1 (0.41) | ALDH1A1TP53TSHR | |
| SCHEMBL28821507 | 0.86 | ALDH1A1 (0.41) | ALDH1A1TP53TSHR | |
| SCHEMBL28456697 | 0.86 | CA2 (0.33) | — | |
| Chloromethane SCHEMBL28080031 | 0.83 | CA2 (0.32) | ALDH1A1TSHR | |
| SCHEMBL28823736 | 0.83 | CA2 (0.32) | — | |
| SCHEMBL27623481 | 0.83 | CA2 (0.35) | — | |
| SCHEMBL150679 | 0.83 | ALDH1A1 (0.44) | ALDH1A1TP53TSHR | |
| SCHEMBL52 | 0.83 | CA2 (0.35) | — | |
| SCHEMBL27674141 | 0.81 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111448194-A | 3-amino- [1,2, 4] -triazole derivatives and their use for controlling undesired vegetation | 拜耳作物科学股份公司 | 2020-07-24 | — | — | CN | disclosed |
| CN-111031799-A | Substituted isothiazolopyridinones, method for the production thereof and use thereof as herbicides and/or plant growth regulators | 拜耳作物科学股份公司 | 2020-04-17 | — | — | CN | disclosed |
| CN-110650628-A | Trisubstituted silylheteroaryloxyquinolines and analogs thereof | 拜耳公司 | 2020-01-03 | — | — | CN | disclosed |
| CN-110582484-A | Trisubstituted silylmethylphenoxyquinolines and analogs thereof | 拜耳公司 | 2019-12-17 | — | — | CN | disclosed |