Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 3/20 | 0.42 |
| ▸ | ERCC5 | P28715 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CTSA | P10619 | 2/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10497400 | 0.87 | CTSA (0.45) | CASP1CTSA | |
| SCHEMBL19612686 | 0.83 | CASP1 (0.43) | CASP1KCNQ2MEN1KMT2AACP3 | |
| SCHEMBL12158738 | 0.83 | L3MBTL1 (0.55) | MEN1KMT2AALDH1A1LMNAMAPT | |
| SCHEMBL2632968 | 0.78 | NISCH (0.47) | CASP1AOC3ADRB2ADRB1LMNA | |
| SCHEMBL620308 | 0.78 | GABBR2 (0.47) | MEN1KMT2ALMNAMAPT | |
| SCHEMBL27644289 | 0.75 | GRIK1 (0.47) | CASP1 | |
| SCHEMBL19612663 | 0.74 | CASP1 (0.41) | CASP1KCNQ2MEN1KMT2AALDH1A1 | |
| SCHEMBL6683975 | 0.73 | NISCH (0.43) | CASP1AOC3ADRB2ADRB1LMNA | |
| SCHEMBL27644724 | 0.73 | ADRB2 (0.39) | CASP1KCNQ2ACP3ALDH1A1AOC3 | |
| SCHEMBL4984391 | 0.73 | NISCH (0.42) | CASP1KCNQ2MEN1KMT2AACP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4472380-A | CARBOXYALKYL DIPEPTIDE DERIVATIVES | MERCK & CO., INC. (US) | 1984-09-18 | — | — | US | disclosed |
| US-4374829-A | Aminoacid derivatives as antihypertensives | MERCK & CO., INC. (US) | 1983-02-22 | — | — | US | disclosed |