Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.47 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MMP1 | P03956 | 2/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | MMP9 | P14780 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL1582564 | 0.83 | MAOB (0.61) | LMNAKMT2AMMP1MMP2MMP9 | |
| SCHEMBL1694508 | 0.83 | MAOB (0.61) | LMNAKMT2AMMP1MMP2MMP9 | |
| SCHEMBL11551476 | 0.81 | LMNA (0.47) | HSD11B1GRIK1GRIK2LMNATP53 | |
| SCHEMBL9790517 | 0.79 | RAB9A (0.54) | LMNAPOLBKMT2AMMP1MMP2 | |
| SCHEMBL9790513 | 0.79 | RAB9A (0.54) | LMNAPOLBKMT2AMMP1MMP2 | |
| SCHEMBL1694974 | 0.77 | MAPT (0.51) | GRIK1GRIK2LMNAKMT2AMAOB | |
| SCHEMBL1694975 | 0.77 | MAPT (0.51) | GRIK1GRIK2LMNAKMT2AMAOB | |
| SCHEMBL5311091 | 0.76 | PAM (0.68) | HSD11B1GRIK1GRIK2LMNATP53 | |
| SCHEMBL5311088 | 0.76 | PAM (0.68) | HSD11B1GRIK1GRIK2LMNATP53 | |
| SCHEMBL21568848 | 0.75 | NFE2L2 (0.50) | HSD11B1LMNATP53POLBNFE2L2 |
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-1814537-A2 | MACROCYCLIC TERTIARY AMINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | Merck & Co., Inc. (US) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006055434-A2 | MACROCYCLIC TERTIARY AMINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2006-05-26 | — | — | WO | disclosed |