Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | IDH1 | O75874 | 3/20 | 0.38 |
| ▸ | IDH2 | P48735 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.31 |
| ▸ | MPL | P40238 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD4 | P21917 | 1/20 | 0.30 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL31445247 | 1.00 | HTR7 (0.43) | HTR7IDH1IDH2GABRA1GABRG2 | |
| SCHEMBL4452048 | 0.79 | HTR7 (0.47) | HTR7HTR1ADRD2 | |
| SCHEMBL2302960 | 0.75 | CYP3A4 (0.42) | IDH1IDH2MPL | |
| SCHEMBL30319918 | 0.75 | NOS3 (0.40) | IDH1IDH2SCN5AMPL | |
| SCHEMBL20049307 | 0.75 | IDH1 (0.38) | IDH1IDH2MPLTGFBR1HTR1A | |
| SCHEMBL16289639 | 0.75 | IDH1 (0.38) | IDH1IDH2MPLTGFBR1HTR1A | |
| SCHEMBL2302655 | 0.75 | NOS3 (0.40) | IDH1IDH2SCN5AMPL | |
| SCHEMBL13680498 | 0.75 | CCR1 (0.43) | IDH1IDH2GRM5 | |
| SCHEMBL3386747 | 0.75 | HTR7 (0.51) | HTR7GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL22489576 | 0.75 | IDH1 (0.39) | IDH1IDH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2350008-B1 | METHOD FOR THE PREPARATION OF FUNCTIONALIZED TRIHALOMETHOXY SUBSTITUTED PYRIDINES | BAYER CROPSCIENCE AG (DE) | 2012-09-05 | — | — | EP | disclosed |
| EP-2350008-A1 | METHOD FOR THE PREPARATION OF FUNCTIONALIZED TRIHALOMETHOXY SUBSTITUTED PYRIDINES | Bayer CropScience AG (DE) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010040461-A1 | METHOD FOR THE PREPARATION OF FUNCTIONALIZED TRIHALOMETHOXY SUBSTITUTED PYRIDINES | BAYER CROPSCIENCE AG (DE) | 2010-04-15 | — | — | WO | disclosed |