Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | GLS | O94925 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.41 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL12984975 | 0.81 | ALDH1A1 (0.50) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL335277 | 0.81 | ALDH1A1 (0.54) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL48506 | 0.81 | ALDH1A1 (0.50) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL533931 | 0.79 | ALDH1A1 (0.46) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL29411715 | 0.79 | ALDH1A1 (0.46) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL353553 | 0.77 | GLS (0.52) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL3249872 | 0.77 | CTSG (0.53) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL1738690 | 0.76 | GRM2 (0.45) | ALDH1A1GAAHSD17B10GLSGRM2 | |
| SCHEMBL12106784 | 0.76 | CTBP2 (0.54) | ALDH1A1GLS | |
| SCHEMBL646928 | 0.75 | ALDH1A1 (0.50) | ALDH1A1GAAHSD17B10GLSGRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1480962-A1 | 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS | Novartis AG (CH) | 2004-12-01 | — | — | EP | disclosed |
| WO-2003072557-A1 | 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS | NOVARTIS AG (CH) | 2003-09-04 | — | — | WO | disclosed |