Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN5A | Q14524 | 3/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.39 |
| ▸ | CHRNG | P07510 | 1/20 | 0.39 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.39 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CHRND | Q07001 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL305401 | 0.87 | CYP3A4 (0.41) | CYP2C19ALDH1A1ALOX15LMNAMAPT | |
| SCHEMBL24019664 | 0.85 | SLC6A2 (0.42) | SCN5ASCN9APKMSLC6A2CHRNA1 | |
| SCHEMBL4189746 | 0.82 | RXRA (0.47) | CYP2C19KIF11ALDH1A1ALOX15LMNA | |
| SCHEMBL24112745 | 0.82 | HPGD (0.40) | SCN5ASCN9APKMSLC6A2CHRNA1 | |
| SCHEMBL25769444 | 0.82 | SCN5A (0.44) | SCN5ASCN9APKMSLC6A2CHRNA1 | |
| SCHEMBL26059368 | 0.81 | CYP3A4 (0.53) | CYP2C19KIF11ALDH1A1PARP1LMNA | |
| SCHEMBL24740445 | 0.80 | SLC6A2 (0.40) | SCN5ASCN9APKMSLC6A2CHRNA1 | |
| SCHEMBL25563995 | 0.79 | KCNN4 (0.50) | PARP1NPC1RAB9AMAOBHTT | |
| SCHEMBL25564023 | 0.79 | CES2 (0.49) | CYP2C19ALDH1A1SMN1; SMN2RAB9AMAOB | |
| SCHEMBL24019745 | 0.79 | HPGD (0.43) | SLC6A2CHRNA1CHRNGITGA5CHRNB1 |
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-2021252644-A1 | INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF | Pardes Biosciences, Inc. (US) | 2021-12-16 | — | — | WO | disclosed |