Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | CTSB | P07858 | 2/20 | 0.48 |
| ▸ | CTSS | P25774 | 2/20 | 0.48 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYSLTR1 | Q9Y271 | 4/20 | 0.45 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.45 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | ECE1 | P42892 | 1/20 | 0.45 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL7299398 | 1.00 | CTSL (0.48) | CTSLCTSBCTSSADAMTS4MEN1 | |
| SCHEMBL7307096 | 0.90 | ADAMTS4 (0.55) | ADAMTS4CYP1A2CYSLTR1GPBAR1CYSLTR2 | |
| SCHEMBL7298298 | 0.90 | ADAMTS4 (0.55) | ADAMTS4CYP1A2CYSLTR1GPBAR1CYSLTR2 | |
| SCHEMBL7295767 | 0.85 | GPBAR1 (0.46) | ADAMTS4CTSKCYP1A2CYSLTR1GPBAR1 | |
| SCHEMBL7306884 | 0.82 | CYP1A2 (0.48) | ADAMTS4CYP1A2CYSLTR1GPBAR1CYSLTR2 | |
| SCHEMBL7306877 | 0.82 | CYP1A2 (0.48) | ADAMTS4CYP1A2CYSLTR1GPBAR1CYSLTR2 | |
| SCHEMBL7304710 | 0.81 | CTSL (0.47) | CTSLCTSBCTSSMEN1KMT2A | |
| SCHEMBL7310554 | 0.80 | RAB9A (0.55) | CTSLCTSBCTSSADAMTS4MEN1 | |
| SCHEMBL7310548 | 0.80 | RAB9A (0.55) | CTSLCTSBCTSSADAMTS4MEN1 | |
| SCHEMBL8984331 | 0.79 | ALOX5AP (0.46) | ADAMTS4CYP1A2CYSLTR1GPBAR1CYSLTR2 |
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 5 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-0652009-A1 | Identification and use of protease inhibitors | ELI LILLY AND COMPANY (US) | 1995-05-10 | — | — | EP | disclosed |
| CN-1082035-A | The inhibitors of hiv protease that is used for the treatment of AIDS | LILLY CO ELI (US) | 1994-02-16 | — | — | CN | 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 |