Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 4/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16468936 | 0.81 | KCNK3 (0.52) | SMN1; SMN2CNR1CNR2HTTPOLB | |
| SCHEMBL2038078 | 0.80 | SMN1; SMN2 (0.47) | SMN1; SMN2LMNACYP2C19HSD17B10 | |
| SCHEMBL13555216 | 0.80 | SMN1; SMN2 (0.47) | SMN1; SMN2LMNACYP2C19HSD17B10 | |
| SCHEMBL19772430 | 0.79 | KCNK3 (0.44) | SMN1; SMN2CNR1CNR2POLBFKBP1A | |
| SCHEMBL4555126 | 0.78 | SPHK1 (0.40) | SMN1; SMN2POLBLMNA | |
| SCHEMBL18555352 | 0.78 | SPHK1 (0.40) | SMN1; SMN2POLBLMNA | |
| SCHEMBL12733396 | 0.74 | CYP3A4 (0.50) | SMN1; SMN2POLBALDH1A1LMNAL3MBTL1 | |
| SCHEMBL26501809 | 0.74 | CYP3A4 (0.50) | SMN1; SMN2POLBALDH1A1LMNAL3MBTL1 | |
| SCHEMBL25771149 | 0.73 | LMNA (0.39) | SMN1; SMN2POLBALDH1A1LMNAL3MBTL1 | |
| SCHEMBL25771141 | 0.73 | LMNA (0.39) | SMN1; SMN2POLBALDH1A1LMNAL3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0873519-A4 | HIV PROTEASE INHIBITORS | SCRIPPS RESEARCH INST (US) | 2005-04-27 | — | — | EP | disclosed |
| EP-0873519-A1 | HIV PROTEASE INHIBITORS | The Scripps Research Institute (US) | 1998-10-28 | — | — | EP | disclosed |
| WO-1997021100-A9 | HIV PROTEASE INHIBITORS | — | 1997-10-30 | — | — | WO | disclosed |
| WO-1997021100-A1 | HIV PROTEASE INHIBITORS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1997-06-12 | — | — | WO | disclosed |