Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | LPAR3 | Q9UBY5 | 4/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.42 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | CDC25A | P30304 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL672324 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL639062 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL672113 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL3961976 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL3967242 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL672326 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL14975431 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL7612294 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL153474 | 0.96 | CYP3A4 (0.54) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 | |
| SCHEMBL17626465 | 0.89 | LPAR3 (0.50) | CYP3A4HPGDSMN1; SMN2LPAR3LPAR1 |
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-112048111-B | Process for preparing blends of cis-1, 4-polybutadiene and syndiotactic 1, 2-polybutadiene | 株式会社普利司通 | 2022-12-02 | — | — | CN | disclosed |
| CN-112048111-A | Process for preparing blends of cis-1, 4-polybutadiene and syndiotactic 1, 2-polybutadiene | 株式会社普利司通 | 2020-12-08 | — | — | CN | disclosed |