Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.39 |
| ▸ | CTSK | P43235 | 3/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18181147 | 1.00 | CTSS (0.39) | CTSSCTSKCTSLCTSBKDM1A | |
| SCHEMBL21992131 | 0.89 | CTSL (0.39) | CTSSCTSKCTSLCTSBKDM1A | |
| SCHEMBL18181041 | 0.89 | CTSL (0.39) | CTSSCTSKCTSLCTSBKDM1A | |
| SCHEMBL18181100 | 0.88 | KDM1A (0.42) | CTSSCTSKCTSLCTSBKDM1A | |
| SCHEMBL18181046 | 0.86 | KDM1A (0.41) | KDM1AMAOA | |
| SCHEMBL18181355 | 0.86 | KDM1A (0.42) | CTSSCTSKCTSLCTSBKDM1A | |
| SCHEMBL19999800 | 0.84 | KDM1A (0.41) | KDM1AMAOA | |
| SCHEMBL19999799 | 0.83 | KDM1A (0.40) | CTSSCTSKCTSLCTSBKDM1A | |
| SCHEMBL19999815 | 0.83 | KDM1A (0.44) | KDM1AMAOA | |
| SCHEMBL18181364 | 0.82 | KDM1A (0.46) | CTSSCTSKCTSLCTSBKDM1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3286166-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV HEALTHCARE UK NO 5 LTD (GB) | 2020-05-13 | — | — | EP | disclosed |