Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.52 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.52 |
| ▸ | ACE | P12821 | 3/20 | 0.50 |
| ▸ | NPY4R | P50391 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | MDM4 | O15151 | 1/20 | 0.45 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.45 |
| ▸ | HPGDS | O60760 | 2/20 | 0.43 |
| ▸ | PTPRA | P18433 | 1/20 | 0.43 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2587894 | 0.90 | PTPN1 (0.52) | PTPN1PTPN2ACEHPGDSPTPRA | |
| SCHEMBL2589812 | 0.84 | PTPN1 (0.44) | PTPN1PTPN2ACENPY4RPTPRA | |
| SCHEMBL16602248 | 0.83 | HDAC3 (0.55) | PTPN1HPGDS | |
| SCHEMBL16656665 | 0.83 | OPRD1 (0.48) | ACEOPRD1OPRM1OPRK1MDM4 | |
| SCHEMBL25627130 | 0.81 | PTPN1 (0.52) | PTPN1PTPN2ACEOPRD1OPRM1 | |
| SCHEMBL6757142 | 0.80 | PTPN2 (0.52) | PTPN1PTPN2ACENPY4ROPRD1 | |
| SCHEMBL15839930 | 0.79 | OPRD1 (0.54) | OPRD1OPRM1OPRK1 | |
| SCHEMBL4386989 | 0.77 | PTPN2 (0.52) | PTPN1PTPN2ACEHPGDS | |
| SCHEMBL5594950 | 0.77 | PTPN2 (0.52) | PTPN1PTPN2ACEHPGDS | |
| Trifluoroacetic Acid SCHEMBL2588851 | 0.77 | TACR1 (0.55) | ACEMDM4MDM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8350077-B2 | Amides of creatine, method of their preparation, and remedy possessing a neuroprotective activity | VERTEX CLOSED JOINT STOCK COMPANY (RU) | 2013-01-08 | — | — | US | disclosed |
| US-20110269986-A1 | AMIDES OF CREATNE, METHOD OF THEIR PREPARATION, AND REMEDY POSSESSING A NEUROPROTECTIVE ACTIVITY | AMIDE BEVERAGE COMPANY, LLC | 2011-11-03 | — | — | US | disclosed |