Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.61 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.40 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.40 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27362342 | 0.82 | PRKCI (0.55) | AHRCYP1B1S1PR1PTPN5KCNH2 | |
| SCHEMBL92905 | 0.81 | IDO1 (0.58) | S1PR1IDO1PNMTTAAR1IGF1R | |
| SCHEMBL11071591 | 0.80 | AHR (0.64) | AHRCYP1B1S1PR1S1PR5IDO1 | |
| SCHEMBL9241133 | 0.79 | AHR (0.50) | AHRCYP1B1S1PR1S1PR5IDO1 | |
| SCHEMBL5558540 | 0.78 | TAAR1 (0.62) | AHRCYP1B1S1PR1S1PR5IDO1 | |
| SCHEMBL12603805 | 0.78 | AHR (0.61) | AHRCYP1B1S1PR1S1PR5IDO1 | |
| SCHEMBL29769221 | 0.78 | AHR (1.00) | AHRCYP1B1KMOSCN9AESR2 | |
| SCHEMBL11310791 | 0.78 | MKNK1 (0.56) | KIF11MKNK1MKNK2 | |
| SCHEMBL137915 | 0.78 | AHR (1.00) | AHRCYP1B1KMOSCN9AESR2 | |
| SCHEMBL679970 | 0.78 | MKNK1 (0.56) | KIF11MKNK1MKNK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009071504-A1 | 2,6-DISUBSTITUTED PYRIDINES AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-11 | — | — | WO | disclosed |