Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHCY | P23526 | 2/20 | 0.57 |
| ▸ | NADK | O95544 | 1/20 | 0.57 |
| ▸ | NT5E | P21589 | 1/20 | 0.57 |
| ▸ | AMD1 | P17707 | 1/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.57 |
| ▸ | P2RY1 | P47900 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | P2RY2 | P41231 | 3/20 | 0.57 |
| ▸ | DOT1L | Q8TEK3 | 2/20 | 0.57 |
| ▸ | SRC | P12931 | 2/20 | 0.57 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.57 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.57 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.57 |
| ▸ | LDHA | P00338 | 1/20 | 0.57 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.57 |
| ▸ | FBP1 | P09467 | 1/20 | 0.57 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.57 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.57 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL7716880 | 0.86 | AHCY (0.55) | AHCYNADKNT5EAMD1ADORA1 | |
| SCHEMBL7027633 | 0.84 | ADORA1 (0.69) | AHCYNADKNT5EAMD1ADORA1 | |
| SCHEMBL1553926 | 0.84 | ADORA1 (0.67) | AHCYNADKNT5EADORA1P2RY1 | |
| SCHEMBL859643 | 0.84 | ADORA1 (0.67) | AHCYNADKNT5EADORA1P2RY1 | |
| SCHEMBL7435435 | 0.83 | AHCY (0.71) | AHCYNADKNT5EAMD1ADORA1 | |
| SCHEMBL17909973 | 0.82 | AHCY (0.66) | AHCYNADKAMD1ADORA1SMN1; SMN2 | |
| SCHEMBL6635765 | 0.79 | ADORA3 (0.49) | AHCYNADKNT5EADORA1P2RY1 | |
| SCHEMBL7321557 | 0.79 | NT5E (0.68) | AHCYNADKNT5EADORA1P2RY1 | |
| SCHEMBL481524 | 0.79 | ADORA1 (0.76) | AHCYNADKNT5EAMD1ADORA1 | |
| SCHEMBL2040670 | 0.79 | ADORA1 (0.76) | AHCYNADKNT5EAMD1ADORA1 |
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-6392049-B1 | NITRATION USING NITRIC ACID | AVENTIS PHARMACEUTICALS INC. | 2002-05-21 | — | — | US | disclosed |
| US-6307054-B1 | HEATING A 5-CARBOXY-2,4-DIHYROXYPYRIDINE AND PHOSPHORIC ACID WHERE THE RATIO OF PHOSPHORIC ACID TO WATER IS NOT LESS THAN ABOUT 27 TO 1 WEIGHT %. | AVENTIS PHARMACEUTICALS PRODUCTS INC. | 2001-10-23 | — | — | US | disclosed |