Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | FABP4 | P15090 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10649978 | 0.93 | MAPK1 (0.46) | MAPK1TDP1L3MBTL1ALDH1A1HTT | |
| SCHEMBL10873353 | 0.85 | ALDH1A1 (0.47) | MAPK1TDP1L3MBTL1NPSR1ALDH1A1 | |
| SCHEMBL9620470 | 0.79 | ALDH1A1 (0.54) | MAPK1L3MBTL1ALDH1A1HTTMAPT | |
| SCHEMBL9811280 | 0.78 | ALDH1A1 (0.39) | MAPK1TDP1L3MBTL1ALDH1A1HTT | |
| SCHEMBL10652013 | 0.76 | VCAM1 (0.47) | TDP1L3MBTL1ALDH1A1MAPTTSHR | |
| SCHEMBL4815935 | 0.75 | TDP1 (0.54) | MAPK1TDP1L3MBTL1ALDH1A1MAPT | |
| SCHEMBL10653026 | 0.75 | TDP1 (0.45) | TDP1L3MBTL1ALDH1A1MAPTTSHR | |
| SCHEMBL10741160 | 0.71 | ALDH1A1 (0.43) | MAPK1TDP1L3MBTL1ALDH1A1HTT | |
| SCHEMBL10571766 | 0.71 | NPY5R (0.46) | TDP1ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL10656087 | 0.70 | KMT2A (0.50) | TDP1L3MBTL1ALDH1A1HTTMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0197386-B1 | 2-(SUBSTITUTED SULFAMYL) DERIVATIVES OF 6-NITROBENZOIC ACID, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1988-11-02 | — | — | EP | disclosed |
| US-4654369-A | Esters of 2-(substituted sulfamyl)-6-nitro-benzoic acid and pharmaceutical compositions | MERCK & CO., INC. (US) | 1987-03-31 | — | — | US | disclosed |
| EP-0197386-A1 | 2-(Substituted sulfamyl) derivatives of 6-nitrobenzoic acid, process for their preparation and pharmaceutical compositions containing them | MERCK & CO. INC. (US) | 1986-10-15 | — | — | EP | disclosed |