Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 4/20 | 0.46 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.46 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CTH | P32929 | 1/20 | 0.36 |
| ▸ | PPID | Q08752 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16619930 | 1.00 | MAPT (0.61) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL23137248 | 0.91 | MAPT (0.50) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL16629726 | 0.91 | MAPT (0.50) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL17986559 | 0.91 | MAPT (0.50) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL23115610 | 0.85 | GAA (0.46) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL30107049 | 0.84 | MAPT (0.43) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL3853327 | 0.78 | MAPT (0.68) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL3853323 | 0.78 | MAPT (0.68) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL388339 | 0.78 | MAPT (0.68) | MAPTGAAMGAMSIMGAM2 | |
| SCHEMBL388338 | 0.78 | MAPT (0.68) | MAPTGAAMGAMSIMGAM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3052099-A1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | Merck Sharp & Dohme Corp. (US) | 2016-08-10 | — | — | EP | disclosed |
| WO-2015050798-A1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2015-04-09 | — | — | WO | disclosed |