Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8474228 | 0.86 | ALDH1A1 (0.52) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL8334285 | 0.76 | ALDH1A1 (0.54) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL15700139 | 0.75 | ALDH1A1 (0.47) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL14866021 | 0.75 | TDP1 (0.58) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL21715106 | 0.75 | HSD11B1 (0.71) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL9631343 | 0.74 | HSD11B1 (0.60) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL8475112 | 0.74 | TDP1 (0.54) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL8474009 | 0.74 | TDP1 (0.54) | ALDH1A1POLBL3MBTL1GAAHSD11B1 | |
| SCHEMBL3625848 | 0.74 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1GAAHSD11B1TDP1 | |
| SCHEMBL1332360 | 0.74 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1GAAHSD11B1TDP1 |
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 3 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 |
| EP-0012401-A1 | Carboxyalkyl dipeptide derivatives, process for preparing them and pharmaceutical composition containing them | MERCK & CO. INC. (US) | 1980-06-25 | — | — | EP | disclosed |