Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.49 |
| ▸ | PTPRC | P08575 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27513616 | 1.00 | PTPN1 (0.49) | PTPN1PTPRCALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL27463771 | 0.86 | ALDH1A1 (0.49) | PTPN1PTPRCALDH1A1HCAR2KMT2A | |
| SCHEMBL10789564 | 0.82 | ALDH1A1 (0.50) | PTPN1PTPRCALDH1A1HCAR2KMT2A | |
| SCHEMBL5711180 | 0.80 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2HIF1AMAPK1SLC6A2 | |
| SCHEMBL8071398 | 0.80 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2HIF1AMAPK1SLC6A2 | |
| SCHEMBL8385923 | 0.80 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2HIF1AKMT2ASLC6A2 | |
| SCHEMBL8385924 | 0.80 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2HIF1AKMT2ASLC6A2 | |
| SCHEMBL27899381 | 0.79 | ALDH1A1 (0.51) | PTPN1PTPRCALDH1A1SMN1; SMN2HCAR2 | |
| SCHEMBL7299993 | 0.78 | NPC1 (0.42) | ALDH1A1SMN1; SMN2KMT2ACA12CA1 | |
| SCHEMBL5972169 | 0.78 | SMN1; SMN2 (0.68) | PTPN1PTPRCALDH1A1SMN1; SMN2HIF1A |
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-0812857-A1 | Irreversible HIV protease inhibitors, compositions containing same and process for the preparation thereof | LG Chemical Limited (KR) | 1997-12-17 | — | — | EP | disclosed |
| US-5679687-A | Irreversible HIV protease inhibitors, compositions containing same and process for the preparation thereof | LG CHEMICAL LIMITED (KR) | 1997-10-21 | — | — | US | disclosed |