Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 2/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774805 | 0.85 | NQO1 (0.41) | CYP11B1CYP11B2ACACB | |
| SCHEMBL8774435 | 0.82 | ACACB (0.40) | ACACB | |
| SCHEMBL8774602 | 0.82 | ACACB (0.39) | APPACACBL3MBTL1ALDH1A1 | |
| SCHEMBL8775031 | 0.81 | CYP11B1 (0.39) | CYP11B1CYP11B2ACACBMCHR1ALDH1A1 | |
| SCHEMBL8774095 | 0.80 | NR5A1 (0.41) | ACACBL3MBTL1ALDH1A1 | |
| SCHEMBL9159082 | 0.79 | APP (0.47) | APPKCNH2TRPV3CYP11B1CYP11B2 | |
| SCHEMBL8775170 | 0.79 | CYP2D6 (0.46) | MCHR1L3MBTL1ALDH1A1 | |
| SCHEMBL8774463 | 0.79 | MCHR1 (0.41) | ACACBMCHR1ALDH1A1 | |
| SCHEMBL8774297 | 0.78 | FFAR1 (0.40) | ACACB | |
| SCHEMBL19999378 | 0.76 | APP (0.47) | APPKCNH2ACACBMCHR1PDE4D |
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-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |