Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | OTC | P00480 | 1/20 | 0.33 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.33 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.32 |
| ▸ | NPY4R | P50391 | 4/20 | 0.31 |
| ▸ | NPY1R | P25929 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL288819 | 1.00 | NOS2 (0.38) | NOS2NOS3NOS1ALOX15MEN1 | |
| SCHEMBL196827 | 1.00 | NOS2 (0.38) | NOS2NOS3NOS1ALOX15MEN1 | |
| SCHEMBL29770073 | 1.00 | NOS2 (0.38) | NOS2NOS3NOS1ALOX15MEN1 | |
| SCHEMBL160690 | 1.00 | NOS2 (0.38) | NOS2NOS3NOS1ALOX15MEN1 | |
| Hydrochloric Acid SCHEMBL12078158 | 0.98 | NOS3 (0.37) | NOS2NOS3NOS1ALOX15MEN1 | |
| Hydrochloric Acid SCHEMBL2595284 | 0.98 | NOS3 (0.37) | NOS2NOS3NOS1ALOX15MEN1 | |
| Hydrochloric Acid SCHEMBL12078437 | 0.98 | NOS3 (0.37) | NOS2NOS3NOS1ALOX15MEN1 | |
| Hydrochloric Acid SCHEMBL2595285 | 0.98 | NOS3 (0.37) | NOS2NOS3NOS1ALOX15MEN1 | |
| Dimethylamine SCHEMBL27821422 | 0.97 | NOS3 (0.36) | NOS2NOS3NOS1ALOX15MEN1 | |
| SCHEMBL1697811 | 0.95 | ALOX15 (0.38) | NOS2NOS3NOS1ALOX15MEN1 |
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-2449488-A1 | METHOD FOR NORMALIZATION IN METABOLOMICS ANALYSIS METHODS WITH ENDOGENOUS REFERENCE METABOLITES | BIOCRATES Life Sciences AG (AT) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011000753-A1 | METHOD FOR NORMALIZATION IN METABOLOMICS ANALYSIS METHODS WITH ENDOGENOUS REFERENCE METABOLITES | BIOCRATES LIFE SCIENCES AG (AT) | 2011-01-06 | — | — | WO | disclosed |