Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 7/20 | 0.46 |
| ▸ | RAB9A | P51151 | 7/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL909197 | 0.85 | NPC1 (0.48) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28317404 | 0.82 | NPC1 (0.45) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9383229 | 0.80 | ALDH1A1 (0.49) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7982607 | 0.79 | ADORA2A (0.43) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28514274 | 0.76 | NPSR1 (0.47) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14781502 | 0.75 | PIK3CA (0.50) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28803894 | 0.75 | ADORA3 (0.51) | NPSR1ADORA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL496758 | 0.74 | NPC1 (0.60) | NPSR1ADORA3NPC1RAB9APTGS1 | |
| Hydrochloric Acid SCHEMBL21834227 | 0.72 | NPC1 (0.59) | NPSR1ADORA3NPC1RAB9APTGS1 | |
| SCHEMBL3836508 | 0.71 | NPC1 (0.57) | NPSR1ADORA3NPC1RAB9APTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2318367-B1 | PIPERIDINE AND PYRROLIDINE COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-03-20 | — | — | EP | claimed |