Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8190937 | 0.91 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL10604591 | 0.90 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL14027267 | 0.85 | ALDH1A1 (0.72) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL14027269 | 0.85 | ALDH1A1 (0.72) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL18736058 | 0.85 | MTNR1A (0.72) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL3542328 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL6376361 | 0.84 | ALDH1A1 (0.73) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL6376395 | 0.84 | MTNR1A (0.71) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL6377560 | 0.84 | ALDH1A1 (0.73) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL29944228 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1SMN1; SMN2POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-6043253-A | TREATMENT OF DIABETES, OBESITY, LOWERING TRIGLYCERIDE OR CHOLESTEROL LEVELS, INCREASING HIGH DENSITY LIPOPROTEIN LEVELS OR DECREASING GUT MOTILITY, REDUCING NEUROGENIC INFLAMMATION, DEPRESSION OR GASTROINTESTINAL DISORDERS | MERCK & CO., INC. (US) | 2000-03-28 | — | — | US | disclosed |