Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | TP53 | P04637 | 4/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | RBP4 | P02753 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10122318 | 0.95 | NPC1 (0.52) | NPC1HSD11B1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL10123536 | 0.79 | MAPK1 (0.56) | SMN1; SMN2TP53RBP4CYP2C19MAPT | |
| SCHEMBL10123504 | 0.78 | LMNA (0.45) | NPC1RAB9ASMN1; SMN2CYP2C19MAPT | |
| SCHEMBL13993504 | 0.74 | GAA (0.45) | NPC1RAB9ASMN1; SMN2HTTEPHX2 | |
| SCHEMBL571141 | 0.73 | KDM1A (0.60) | NPC1HSD11B1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL13328860 | 0.73 | RIPK1 (0.58) | NPC1HSD11B1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL10122256 | 0.73 | MAPK1 (0.58) | SMN1; SMN2TP53RBP4CYP2C19MAPT | |
| SCHEMBL10123383 | 0.73 | GAA (0.44) | NPC1RAB9ASMN1; SMN2CYP2C19HTT | |
| SCHEMBL10123579 | 0.73 | GAA (0.44) | NPC1RAB9ASMN1; SMN2CYP2C19HTT | |
| SCHEMBL17530362 | 0.72 | NPC1 (0.46) | NPC1HSD11B1RAB9ASMN1; SMN2TP53 |
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-2012060820-A1 | SULFONYL SEMICARBAZIDES, SEMICARBAZIDES AND UREAS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS FOR TREATING HEMORRHAGIC FEVER VIRUSES, INCLUDING INFECTIONS ASSOCIATED WITH ARENAVIRUSES | SIGA TECHNOLOGIES, INC. (US) | 2012-05-10 | — | — | WO | disclosed |