Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.37 |
| ▸ | FDPS | P14324 | 9/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.35 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5436941 | 1.00 | TSHR (0.40) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL28632786 | 1.00 | TSHR (0.40) | TSHRTHRBGGPS1FDPSDNM1 | |
| Hydrochloric Acid SCHEMBL28706465 | 0.98 | TSHR (0.38) | TSHRTHRBGGPS1FDPSDNM1 | |
| Hydrochloric Acid SCHEMBL28690811 | 0.98 | TSHR (0.38) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL28460650 | 0.92 | TSHR (0.42) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL21179492 | 0.92 | TSHR (0.42) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL18722279 | 0.92 | TSHR (0.42) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL28521973 | 0.92 | TSHR (0.42) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL23032963 | 0.91 | DNM1 (0.34) | TSHRTHRBGGPS1FDPSDNM1 | |
| SCHEMBL24130500 | 0.90 | TSHR (0.40) | TSHRTHRBGGPS1FDPSDNM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107445904-B | Pyrimidine-octadecyl quaternary ammonium salt fluorescent whitening agent and preparation method and application thereof | 贺州学院 | 2021-04-13 | — | — | CN | claimed |
| CN-107445904-B | Pyrimidine-octadecyl quaternary ammonium salt fluorescent whitening agent and preparation method and application thereof | 贺州学院 | 2021-04-13 | — | — | CN | disclosed |