Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19783603 | 1.00 | S1PR4 (0.33) | S1PR4CA2CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL30189953 | 0.83 | CCR1 (0.34) | CA2CYP11B1CYP11B2ALDH1A1LMNA | |
| SCHEMBL19782862 | 0.83 | CCR1 (0.34) | CA2CYP11B1CYP11B2ALDH1A1LMNA | |
| SCHEMBL19783747 | 0.83 | PARP1 (0.39) | — | |
| SCHEMBL30189663 | 0.79 | ENPP2 (0.33) | CYP11B1CYP11B2 | |
| SCHEMBL21395879 | 0.79 | ENPP2 (0.33) | CYP11B1CYP11B2 | |
| SCHEMBL19776056 | 0.76 | ALDH1A1 (0.35) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL19783099 | 0.76 | — | — | |
| SCHEMBL19776449 | 0.76 | S1PR4 (0.39) | S1PR4ALDH1A1LMNAMAPTHPGD | |
| SCHEMBL29481826 | 0.76 | S1PR4 (0.39) | S1PR4ALDH1A1LMNAMAPTHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117396469-A | Inhibitors of plasma kallikrein | 武田药品工业株式会社 | 2024-01-12 | — | — | CN | disclosed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |