Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9011863 | 1.00 | CTSS (0.46) | CTSSSYKALDH1A1AAK1CTSK | |
| SCHEMBL18970224 | 0.81 | ALDH1A1 (0.49) | CTSSSYKALDH1A1AAK1CTSK | |
| SCHEMBL9326555 | 0.81 | CTSS (0.44) | CTSSSYKALDH1A1AAK1CTSK | |
| SCHEMBL18265983 | 0.81 | ALDH1A1 (0.51) | CTSSALDH1A1AAK1CTSKMAPK1 | |
| SCHEMBL27870024 | 0.80 | CTSS (0.43) | CTSSSYKALDH1A1AAK1CTSK | |
| SCHEMBL18482798 | 0.80 | ALDH1A1 (0.50) | CTSSALDH1A1AAK1CTSKMAPK1 | |
| SCHEMBL3296206 | 0.79 | ALDH1A1 (0.53) | SYKALDH1A1MAPK1L3MBTL1SLC6A2 | |
| SCHEMBL14065238 | 0.78 | ALDH1A1 (0.49) | CTSSALDH1A1AAK1CTSKMAPK1 | |
| SCHEMBL20608894 | 0.78 | ALDH1A1 (0.49) | CTSSALDH1A1AAK1CTSKMAPK1 | |
| SCHEMBL6473052 | 0.78 | ALDH1A1 (0.49) | CTSSALDH1A1AAK1CTSKMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5545750-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS | ABBOTT LABORATORIES (US) | 1996-08-13 | — | — | US | disclosed |