Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.58 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.58 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.57 |
| ▸ | BRAF | P15056 | 5/20 | 0.56 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.54 |
| ▸ | CSF1R | P07333 | 1/20 | 0.54 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3941624 | 0.82 | KMT2A (0.67) | GAAPTGS1POLBBRAFTRPV1 | |
| SCHEMBL28249147 | 0.81 | RAB9A (0.67) | GAAPTGS1BRAFALDH1A1NPSR1 | |
| SCHEMBL30733198 | 0.81 | RAB9A (0.67) | GAAPTGS1BRAFALDH1A1NPSR1 | |
| SCHEMBL31282022 | 0.81 | MEN1 (0.49) | SCN5ASCN9APOLBTRPV1 | |
| SCHEMBL31606898 | 0.81 | ALDH1A1 (0.62) | GAAPTGS1SCN5ASCN9ABRAF | |
| SCHEMBL26623448 | 0.78 | POLB (0.60) | POLBALDH1A1HSD17B10CYP1A2CYP3A4 | |
| SCHEMBL26623509 | 0.77 | HDAC1 (0.51) | GAASCN5ASCN9APOLB | |
| SCHEMBL29572307 | 0.77 | SORT1 (0.65) | GAAPTGS1POLBBRAFTRPV1 | |
| SCHEMBL24274892 | 0.77 | KCNQ3 (0.61) | GAAPTGS1BRAFCSF1R | |
| SCHEMBL21870341 | 0.77 | GAA (1.00) | GAAPTGS1POLBBRAFALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1831198-B1 | PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS | ASTRAZENECA AB (SE) | 2009-04-08 | — | — | EP | disclosed |