Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.50 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | TP53 | P04637 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.45 |
| ▸ | RELA | Q04206 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | STAT1 | P42224 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | SCD | O00767 | 1/20 | 0.45 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24450335 | 0.88 | RAB9A (0.49) | NPC1RAB9ASMN1; SMN2TP53KCNH2 | |
| SCHEMBL24112355 | 0.86 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2TP53KCNH2 | |
| SCHEMBL24029313 | 0.85 | OPRM1 (0.47) | NPC1RAB9ASMN1; SMN2TP53KCNH2 | |
| SCHEMBL24450336 | 0.77 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2TP53KCNH2 | |
| SCHEMBL2603285 | 0.77 | HRH3 (0.56) | KCNH2HRH3KDM1AOPRM1 | |
| SCHEMBL12609029 | 0.77 | HRH3 (0.56) | KCNH2HRH3KDM1AOPRM1 | |
| SCHEMBL12609017 | 0.77 | HRH3 (0.56) | KCNH2HRH3KDM1AOPRM1 | |
| SCHEMBL25760663 | 0.77 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2TP53KCNH2 | |
| SCHEMBL27498941 | 0.76 | KCNH2 (0.60) | KCNH2HRH3KDM1AOPRM1PRCP | |
| SCHEMBL26238906 | 0.76 | KCNH2 (0.50) | SMN1; SMN2KCNH2HRH3KDM1AOPRM1 |
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 |