Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FGFR4 | P22455 | 11/20 | 0.49 |
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.43 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12654399 | 0.90 | FGFR4 (0.59) | FGFR4KMOCYP3A4CYP2C9GPBAR1 | |
| SCHEMBL12654400 | 0.88 | P2RX1 (0.46) | FGFR4KMOP2RX1CA2CA9 | |
| SCHEMBL12654633 | 0.87 | FGFR4 (0.48) | FGFR4KMONPY5R | |
| SCHEMBL12654527 | 0.87 | FGFR4 (0.56) | FGFR4KMOCYP3A4CYP2C9GPBAR1 | |
| SCHEMBL12654640 | 0.85 | FGFR4 (0.48) | FGFR4KMONPY5R | |
| SCHEMBL12654516 | 0.85 | P2RX1 (0.48) | FGFR4KMOP2RX1CA2CA9 | |
| SCHEMBL12654530 | 0.85 | CA2 (0.44) | FGFR4KMOP2RX1CA2CA9 | |
| SCHEMBL12653832 | 0.84 | FGFR4 (0.44) | FGFR4KMONPY5RCA2CA9 | |
| SCHEMBL12654634 | 0.84 | TRPV1 (0.45) | FGFR4KMOP2RX1CA2CA9 | |
| SCHEMBL12653810 | 0.84 | FGFR4 (0.52) | FGFR4KMOCA2CA9HTR2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9556201-B2 | Bicyclic pyridines and analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-01-31 | — | — | US | disclosed |
| US-9556201-B2 | Bicyclic pyridines and analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-01-31 | — | — | US | disclosed |
| EP-2493888-B1 | BICYCLIC PYRIDINES AND ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2016-04-06 | — | — | EP | disclosed |
| WO-2011059839-A1 | BICYCLIC PYRIDINES AND ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2011-05-19 | — | — | WO | disclosed |