Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.93 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.60 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | F2 | P00734 | 1/20 | 0.53 |
| ▸ | PLG | P00747 | 1/20 | 0.53 |
| ▸ | ELANE | P08246 | 1/20 | 0.53 |
| ▸ | CTSG | P08311 | 1/20 | 0.53 |
| ▸ | CMA1 | P23946 | 1/20 | 0.53 |
| ▸ | CTRC | Q99895 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | EP300 | Q09472 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7829113 | 1.00 | ALDH1A1 (0.93) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL8383162 | 0.96 | ALDH1A1 (1.00) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL8383160 | 0.96 | ALDH1A1 (1.00) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL1023519 | 0.85 | ALDH1A1 (0.73) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL12372537 | 0.85 | ALDH1A1 (0.73) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL13783795 | 0.85 | ALDH1A1 (0.73) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL12620738 | 0.84 | ALDH1A1 (0.73) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL17532457 | 0.84 | ALDH1A1 (0.77) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL651980 | 0.82 | ALDH1A1 (0.69) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 | |
| SCHEMBL8147581 | 0.82 | ALDH1A1 (0.69) | ALDH1A1MT-CO2ALOX5KMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2215076-A2 | COMPOUNDS THAT INHIBIT PROTEASE CATHEPSIN S AND HCV REPLICATION | Virobay, Inc. (US) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009055467-A2 | COMPOUNDS THAT INHIBIT PROTEASE CATHEPSIN S AND HCV REPLICATION | VIROBAY, INC. (US) | 2009-04-30 | — | — | WO | disclosed |