Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 6/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.35 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CLK1 | P49759 | 1/20 | 0.33 |
| ▸ | ROS1 | P08922 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL28635233 | 0.83 | EGLN2 (0.41) | NPC1RAB9AHSD11B1KDM4ETP53 | |
| SCHEMBL28635232 | 0.80 | HSP90AB1 (0.35) | NISCHMAPK14 | |
| SCHEMBL22261806 | 0.71 | CCNB2 (0.37) | NPC1RAB9AMAPK14GCGR | |
| SCHEMBL28632034 | 0.70 | GRM2 (0.35) | NISCHGRM2 | |
| SCHEMBL7500881 | 0.69 | CYP17A1 (0.42) | NISCHCYP17A1KDM4E | |
| SCHEMBL1688524 | 0.69 | NISCH (0.49) | NISCHNPC1RAB9AHSD11B1MAPK14 | |
| SCHEMBL22261800 | 0.68 | NOTUM (0.38) | NISCHNPC1KDM4E | |
| SCHEMBL450465 | 0.66 | — | — | |
| SCHEMBL3383277 | 0.66 | MAPK14 (0.56) | NISCHMAPK14GCGR | |
| SCHEMBL22310234 | 0.66 | NISCH (0.42) | NISCHNPC1RAB9AHSD11B1MAPK14 |
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 |