Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.53 |
| ▸ | RAB9A | P51151 | 8/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23220320 | 0.87 | KMT2A (0.57) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL23220293 | 0.87 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL14134477 | 0.84 | KMT2A (0.49) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL23220337 | 0.84 | GLS (0.54) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL5818812 | 0.84 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL5818813 | 0.84 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL23220309 | 0.84 | GLS (0.54) | NPC1RAB9ASMN1; SMN2GSK3B | |
| SCHEMBL23220315 | 0.82 | GLS (0.49) | NPC1RAB9ASMN1; SMN2GSK3B | |
| SCHEMBL23220305 | 0.82 | KMT2A (0.53) | NPC1RAB9ASMN1; SMN2GSK3BALDH1A1 | |
| SCHEMBL19003798 | 0.82 | GLS (0.55) | NPC1RAB9ASMN1; SMN2GSK3B |
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-2017101793-A1 | 1, 3, 4-SELENADIAZOLE COMPOUNDS WITH PHARMACOLOGICAL ACTIVITY | HANGZHOU JENNIFER BIOTECH CO., LTD. (CN) | 2017-06-22 | — | — | WO | disclosed |