Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SCD | O00767 | 3/20 | 0.32 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | MLYCD | O95822 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21066432 | 0.82 | GSK3B (0.41) | GSK3BSCDSLC8A1HRH3ABL1 | |
| SCHEMBL28312769 | 0.80 | GSK3B (0.39) | GSK3BSCDSLC8A1HRH3MLYCD | |
| SCHEMBL628266 | 0.77 | GSK3B (0.34) | GSK3BMAPK1SCDSLC8A1HRH3 | |
| SCHEMBL30908520 | 0.77 | HCAR2 (0.43) | MLYCDKDM4EALDH1A1HSD17B10KMT2A | |
| SCHEMBL628287 | 0.76 | GSK3B (0.37) | GSK3BSCDSLC8A1HRH3MLYCD | |
| Lithium Ion SCHEMBL31704521 | 0.75 | HDAC3 (0.32) | — | |
| Lithium Ion SCHEMBL31705970 | 0.75 | HDAC3 (0.32) | — | |
| SCHEMBL4025302 | 0.73 | PARP1 (0.41) | GSK3BSCDHRH3MLYCD | |
| SCHEMBL31704833 | 0.72 | LRRK2 (0.40) | GCKHRH3ALDH1A1HSD17B10HPGD | |
| SCHEMBL28570677 | 0.71 | HSD11B1 (0.37) | MAPK1CYP11B1CYP11B2PIK3CGCNR2 |
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-2008060568-A2 | AMIDE-SUBSTITUTED ARYL PIPERIDINES | NEUROGEN CORPORATION (US) | 2008-05-22 | — | — | WO | disclosed |