Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 4/20 | 0.39 |
| ▸ | CNR2 | P34972 | 5/20 | 0.38 |
| ▸ | CTSA | P10619 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21552311 | 0.84 | NR3C1 (0.41) | NR3C1CNR2CTSAHTTPGR | |
| SCHEMBL21552119 | 0.74 | CTSA (0.45) | CTSA | |
| SCHEMBL15998440 | 0.70 | MAPKAPK2 (0.42) | PKMSMN1; SMN2 | |
| SCHEMBL8381068 | 0.69 | ADRB2 (0.36) | CNR2CTSAPKMSMN1; SMN2 | |
| SCHEMBL2040743 | 0.67 | CTSA (0.40) | NR3C1CNR2CTSAPGRAR | |
| SCHEMBL6179952 | 0.67 | ALDH1A1 (0.44) | CTSAPKMSMN1; SMN2 | |
| SCHEMBL10669573 | 0.67 | CTSA (0.49) | CTSA | |
| SCHEMBL4558251 | 0.67 | CTSA (0.39) | NR3C1CTSA | |
| SCHEMBL21552423 | 0.66 | CNR2 (0.39) | NR3C1CNR2CTSA | |
| SCHEMBL21552117 | 0.66 | MEN1 (0.39) | NR3C1CNR2MEN1KMT2APKM |
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-2019216742-A1 | NOVEL COMPOUND EXHIBITING ENTEROPEPTIDASE INHIBITORY ACTIVITY | 주식회사 엘지화학 (KR) | 2019-11-14 | — | — | WO | claimed |