Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 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 | |
|---|---|---|---|---|
| Water SCHEMBL14842093 | 0.98 | PPARA (0.46) | PPARATSHRSMN1; SMN2PTGS2BRD4 | |
| SCHEMBL3395182 | 0.91 | PPARA (0.45) | PPARATSHRSMN1; SMN2PTGS2CA12 | |
| SCHEMBL28295855 | 0.83 | PPARA (0.49) | PPARASMN1; SMN2PTGS2CA12CA1 | |
| SCHEMBL14842018 | 0.81 | CA2 (0.40) | PPARATSHRSMN1; SMN2PTGS2CA1 | |
| Water SCHEMBL14842096 | 0.80 | CA2 (0.40) | PPARATSHRSMN1; SMN2PTGS2CA1 | |
| SCHEMBL3235687 | 0.80 | SLC6A2 (0.41) | TSHRSMN1; SMN2PTGS2CA12CA1 | |
| Bicarbonate SCHEMBL1835067 | 0.78 | PPARA (0.56) | PPARACA12CA1CA2CA9 | |
| SCHEMBL4383694 | 0.78 | PPARA (0.49) | PPARALTB4R2PTGER1PTGER4PTGER3 | |
| SCHEMBL10798302 | 0.77 | DPP4 (0.52) | PPARASMN1; SMN2CA12CA1CA2 | |
| SCHEMBL607543 | 0.77 | DPP4 (0.56) | PPARASMN1; SMN2CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20140296485-A1 | ANIONIC DISPLACER MOLECULES FOR HYDROPHOBIC DISPLACEMENT CHROMATOGRAPHY | PNC BANK, NATIONAL ASSOCIATION | 2014-10-02 | — | — | US | disclosed |
| EP-2763772-A2 | ANIONIC DISPLACER MOLECULES FOR HYDROPHOBIC DISPLACEMENT CHROMATOGRAPHY | Sachem, Inc. (US) | 2014-08-13 | — | — | EP | disclosed |
| WO-2013052537-A2 | ANIONIC DISPLACER MOLECULES FOR HYDROPHOBIC DISPLACEMENT CHROMATOGRAPHY | SACHEM, INC. (US) | 2013-04-11 | — | — | WO | disclosed |