Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.62 |
| ▸ | MAOA | P21397 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 2/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 3/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20118660 | 0.84 | LMNA (0.49) | PHLPP2MAOATSHRHRH3CYP2D6 | |
| SCHEMBL20118526 | 0.81 | LMNA (0.57) | PHLPP2MAOATSHRHRH3CYP2D6 | |
| SCHEMBL20118448 | 0.81 | LMNA (0.46) | PHLPP2MAOATSHRHRH3CYP2D6 | |
| SCHEMBL30232965 | 0.80 | CYP3A4 (0.41) | PHLPP2MAOATSHRHRH3CYP2D6 | |
| SCHEMBL7061424 | 0.80 | NPC1 (0.63) | TSHRCYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL23588775 | 0.80 | CYP3A4 (0.41) | PHLPP2MAOATSHRHRH3CYP2D6 | |
| SCHEMBL20118383 | 0.80 | CYP3A4 (0.44) | PHLPP2MAOATSHRHRH3CYP2D6 | |
| SCHEMBL7057167 | 0.80 | NPC1 (0.63) | TSHRCYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL7062605 | 0.78 | PLAU (0.43) | PHLPP2MAOATSHRSCN1ASCN2A | |
| SCHEMBL20118830 | 0.78 | NPC1 (0.47) | PHLPP2MAOATSHRCYP2D6SCN1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018081513-A1 | PRODRUGS OF KALLIKREIN INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2018-05-03 | — | — | WO | disclosed |