Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 6/20 | 0.41 |
| ▸ | DRD3 | P35462 | 6/20 | 0.41 |
| ▸ | DRD2 | P14416 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12424344 | 0.90 | HSD11B1 (0.40) | HSD11B1EPHX2HTR2ADRD3DRD2 | |
| SCHEMBL17200019 | 0.87 | HSD11B1 (0.46) | HSD11B1HTR2ADRD3DRD2KMT2A | |
| SCHEMBL15014487 | 0.82 | EPHX1 (0.47) | HSD11B1KMT2AHPGDMEN1NPC1 | |
| SCHEMBL13450328 | 0.82 | EPHX2 (0.45) | EPHX2KMT2AHPGDMEN1NPC1 | |
| SCHEMBL12518844 | 0.80 | SMN1; SMN2 (0.55) | EPHX2KMT2AHPGDNPC1MAPT | |
| SCHEMBL16098964 | 0.78 | HPGD (0.56) | EPHX2KMT2AHPGDNPC1MAPT | |
| SCHEMBL10216830 | 0.78 | HSD11B1 (0.41) | HSD11B1HTR2ADRD3DRD2KMT2A | |
| SCHEMBL23221043 | 0.77 | EPHX2 (0.44) | EPHX2KMT2AHPGDMEN1NPC1 | |
| SCHEMBL18134837 | 0.77 | HPGD (0.47) | EPHX2HTR2ADRD3DRD2KMT2A | |
| SCHEMBL941151 | 0.77 | EPHX2 (0.44) | EPHX2KMT2AHPGDMEN1NPC1 |
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-2011029915-A1 | ETHER DERIVATIVES OF BICYCLIC HETEROARYLS | NOVARTIS AG (CH) | 2011-03-17 | — | — | WO | disclosed |