Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 6/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
| ▸ | CTSV | O60911 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.30 |
| ▸ | FABP4 | P15090 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12109361 | 0.89 | PDK2 (0.39) | PTGS1PTGS2TAS2R14PDK2IDO1 | |
| SCHEMBL12109295 | 0.87 | PDK2 (0.37) | PTGS1PTGS2TAS2R14PDK2MAPK14 | |
| SCHEMBL30631793 | 0.86 | PDK2 (0.42) | PTGS1PTGS2TAS2R14PDK2IDO1 | |
| SCHEMBL16892754 | 0.86 | PDK2 (0.42) | PTGS1PTGS2TAS2R14PDK2IDO1 | |
| SCHEMBL15119781 | 0.76 | PDK2 (0.39) | PTGS1PTGS2TAS2R14PDK2MAPT | |
| SCHEMBL25867472 | 0.75 | PDK2 (0.41) | PTGS1PTGS2TAS2R14PDK2IDO1 | |
| SCHEMBL21514744 | 0.75 | PDK2 (0.40) | PTGS1PTGS2PDK2MAPT | |
| SCHEMBL14137142 | 0.73 | PDK2 (0.48) | PTGS1PTGS2PDK2MAPTALOX15 | |
| SCHEMBL12435097 | 0.72 | PGR (0.40) | PTGS1PTGS2TAS2R14PDK2MAPT | |
| SCHEMBL12109355 | 0.72 | MAPT (0.60) | PTGS2MAPTALOX15MEN1KMT2A |
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-2010083871-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2010-07-29 | — | — | WO | disclosed |