Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | FABP7 | O15540 | 1/20 | 0.40 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | PRCP | P42785 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11024334 | 0.83 | KMT2A (0.40) | TSHRNPSR1SLC6A2SLC6A4 | |
| SCHEMBL19398221 | 0.80 | TSHR (0.44) | TSHRNPSR1MAPKAPK2ADRB2KDM1A | |
| SCHEMBL22080378 | 0.79 | CYP3A4 (0.41) | TSHRFABP7FABP5 | |
| SCHEMBL6967406 | 0.78 | TSHR (0.42) | TSHRNPSR1MAPKAPK2SLC6A2SLC6A4 | |
| SCHEMBL4554597 | 0.78 | TSHR (0.42) | TSHRNPSR1MAPKAPK2GLAADRB2 | |
| SCHEMBL7202686 | 0.78 | TSHR (0.62) | TSHRNPSR1MAPKAPK2SLC6A2SLC6A4 | |
| SCHEMBL19225930 | 0.76 | TSHR (0.44) | TSHRNPSR1MAPKAPK2GLAFABP7 | |
| SCHEMBL7436594 | 0.76 | GLA (0.44) | TSHRMAPKAPK2GLAFABP7FABP5 | |
| SCHEMBL11040085 | 0.76 | P2RX4 (0.40) | NPSR1 | |
| SCHEMBL15654433 | 0.74 | ALDH1A1 (0.47) | TSHRNPSR1SLC6A2SLC6A4SLC22A1 |
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-0088350-B1 | CARBOXYALKYL DIPEPTIDES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING CORPORATION (US) | 1985-02-20 | — | — | EP | disclosed |
| EP-0088350-A1 | Carboxyalkyl dipeptides, processes for their production and pharmaceutical compositions containing them | SCHERING CORPORATION (US) | 1983-09-14 | — | — | EP | disclosed |