Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GPX4 | P36969 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2494883 | 0.86 | LMNA (0.43) | NPC1RAB9AALDH1A1SMN1; SMN2CYP4F2 | |
| SCHEMBL4872329 | 0.82 | LMNA (0.41) | NPC1RAB9AALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL10145149 | 0.81 | NPC1 (0.47) | NPC1RAB9AALDH1A1SMN1; SMN2CYP4F2 | |
| SCHEMBL17846085 | 0.79 | NPC1 (0.44) | NPC1RAB9AALDH1A1PAX8TP53 | |
| SCHEMBL9135663 | 0.78 | MEP1B (0.41) | NPC1RAB9AALDH1A1SMN1; SMN2CYP4F2 | |
| SCHEMBL29057034 | 0.76 | LTB4R2 (0.45) | NPC1RAB9AALDH1A1PAX8TP53 | |
| SCHEMBL30505220 | 0.76 | LTB4R2 (0.45) | NPC1RAB9AALDH1A1PAX8TP53 | |
| SCHEMBL8466175 | 0.76 | TP53 (0.51) | NPC1RAB9AALDH1A1PAX8TP53 | |
| SCHEMBL5107372 | 0.75 | CA12 (0.42) | NPC1RAB9AALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL5151051 | 0.75 | LPL (0.41) | NPC1RAB9AALDH1A1PAX8TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1851208-A1 | MACROCYCLIC COMPOUNDS USEFUL AS BACE INHIBITORS | Novartis AG (CH) | 2007-11-07 | — | — | EP | disclosed |
| WO-2006074950-A1 | MACROCYCLIC COMPOUNDS USEFUL AS BACE INHIBITORS | NOVARTIS AG (CH) | 2006-07-20 | — | — | WO | disclosed |