Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 5/20 | 0.45 |
| ▸ | SCN4A | P35499 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | GHSR | Q92847 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7320696 | 0.77 | BACE1 (0.38) | BACE1 | |
| SCHEMBL9776983 | 0.69 | CTSC (0.49) | CTSCSCN4AHTR2CHTR2BGHSR | |
| SCHEMBL11488813 | 0.68 | CTSC (0.80) | CTSCHTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL9753650 | 0.68 | CTSC (0.80) | CTSCHTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL29070774 | 0.68 | CTSC (0.80) | CTSCHTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL9283152 | 0.68 | CTSC (0.65) | CTSCHTR2CHTR2BGHSRCYP1A2 | |
| SCHEMBL19463713 | 0.66 | CTSC (0.46) | CTSCSCN4AHTR2CHTR2BGHSR | |
| SCHEMBL27394991 | 0.66 | SCN4A (0.48) | CTSCSCN4AHTR2CHTR2BGHSR | |
| SCHEMBL10478074 | 0.66 | CTSC (0.46) | CTSCSCN4AHTR2CHTR2BCYP3A4 | |
| SCHEMBL7302727 | 0.66 | SCN4A (0.53) | CTSCSCN4AHTR2CHTR2BGHSR |
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-0352000-A2 | Retroviral protease binding peptides | SMITHKLINE BEECHAM CORPORATION (US) | 1990-01-24 | — | — | EP | disclosed |