Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 5/20 | 0.45 |
| ▸ | CTSB | P07858 | 3/20 | 0.45 |
| ▸ | CTSS | P25774 | 3/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.45 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7298448 | 0.83 | CTSK (0.56) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL305819 | 0.81 | CASP1 (0.48) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL305818 | 0.81 | CASP1 (0.48) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL7295499 | 0.79 | CTSL (0.51) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL4945460 | 0.79 | CTRB1 (0.58) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL7306251 | 0.78 | CTSL (0.59) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL7298678 | 0.77 | MME (0.53) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL7305584 | 0.76 | CYP1A2 (0.53) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL7309667 | 0.76 | CTSL (0.48) | CTSLCTSBCTSSTACR1CTSK | |
| SCHEMBL14879202 | 0.75 | ATM (0.51) | CTSLCTSBCTSSCYP3A4CTSK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0575097-B1 | 2,3-Bis-carboxamidomethyl substituted oxiranes as inhibitors of HIV protease and their use for the treatment of AIDS | LILLY CO ELI (US) | 2000-11-02 | — | — | EP | disclosed |
| US-5578608-A | HIV PROTEASE INHIBITOR | ELI LILLY AND COMPANY (US) | 1996-11-26 | — | — | US | disclosed |
| EP-0575097-A1 | 2,3-Bis-carboxamidomethyl substituted oxiranes as inhibitors of HIV protease and their use for the treatment of AIDS | ELI LILLY AND COMPANY (US) | 1993-12-22 | — | — | EP | disclosed |