Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CTSV | O60911 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 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 | |
|---|---|---|---|---|
| SCHEMBL25805221 | 0.88 | CTSV (0.41) | CYP3A4CTSVCTSSCTSK | |
| SCHEMBL25650808 | 0.88 | CTSV (0.41) | CYP3A4CTSVCTSSCTSK | |
| SCHEMBL25651590 | 0.88 | CTSV (0.41) | CYP3A4CTSVCTSSCTSK | |
| SCHEMBL30237869 | 0.86 | VHL (0.36) | CTSVCTSSCTSKCCR1 | |
| SCHEMBL25650708 | 0.86 | VHL (0.36) | CTSVCTSSCTSKCCR1 | |
| SCHEMBL24697478 | 0.84 | CTSV (0.35) | CTSVCTSSCTSKCCR1 | |
| SCHEMBL25651059 | 0.84 | CCR1 (0.32) | CTSVCTSSCTSKCCR1 | |
| SCHEMBL25650800 | 0.82 | CNR2 (0.32) | CTSVCTSSCTSKCCR1 | |
| SCHEMBL25650684 | 0.81 | ELANE (0.38) | TSHRCTSK | |
| SCHEMBL25954752 | 0.81 | ELANE (0.38) | TSHRCTSK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023114516-A2 | CELL-PERMEANT INHIBITORS OF VIRAL CYSTEINE PROTEASES | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2023-06-22 | — | — | WO | disclosed |