Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.56 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | P4HA1 | P13674 | 1/20 | 0.50 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.50 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | HPGDS | O60760 | 1/20 | 0.44 |
| ▸ | KCNJ1 | P48048 | 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 | |
|---|---|---|---|---|
| SCHEMBL2556293 | 0.91 | LDHA (0.71) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL16991665 | 0.91 | NPC1 (0.51) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL12392719 | 0.91 | LDHA (0.66) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL2343427 | 0.89 | LDHA (0.64) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL22309130 | 0.89 | NPC1 (0.73) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL2343432 | 0.89 | LDHA (0.64) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL30436727 | 0.89 | NPC1 (0.73) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL13100100 | 0.89 | LDHA (0.73) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL2343428 | 0.88 | RXFP1 (0.49) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 | |
| SCHEMBL29123392 | 0.87 | P4HTM (0.64) | LDHANPC1RXFP1BAZ2BSMN1; SMN2 |
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-2011091532-A1 | HEPATITIS C INHIBITOR COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-04 | — | — | WO | disclosed |