Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 6/20 | 0.33 |
| ▸ | OXTR | P30559 | 2/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | FABP1 | P07148 | 1/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28630972 | 0.83 | LMNA (0.36) | HSP90AB1 | |
| SCHEMBL28646753 | 0.80 | NISCH (0.43) | NISCHMAPK14 | |
| SCHEMBL28632034 | 0.77 | GRM2 (0.35) | GRM5NISCHPDE3BPDE3A | |
| SCHEMBL22261801 | 0.75 | NPC1 (0.38) | NISCHMAPK14 | |
| SCHEMBL14039912 | 0.71 | PDE3B (0.44) | HSP90AB1NISCHPDE3BPDE3ANMT1 | |
| SCHEMBL22261806 | 0.71 | CCNB2 (0.37) | MAPK14 | |
| SCHEMBL14886185 | 0.69 | ALDH1A1 (0.42) | HSP90AB1GRM5NISCHFABP1GPBAR1 | |
| SCHEMBL7500881 | 0.69 | CYP17A1 (0.42) | GRM5NISCH | |
| SCHEMBL15152912 | 0.69 | NISCH (0.46) | HSP90AB1NISCH | |
| SCHEMBL22261800 | 0.68 | NOTUM (0.38) | NISCH |
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 |
|---|---|---|---|---|---|---|---|
| CN-108026050-B | Novel compounds as ROR gamma modulators | 格兰马克药品股份有限公司 | 2021-04-30 | — | — | CN | disclosed |