Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 13/20 | 0.78 |
| ▸ | PIM1 | P11309 | 5/20 | 0.58 |
| ▸ | PIM2 | Q9P1W9 | 5/20 | 0.58 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.53 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29029499 | 1.00 | HPGD (0.78) | HPGDPIM1PIM2AKR1B1NPC1 | |
| SCHEMBL6865620 | 0.87 | HPGD (1.00) | HPGDPIM1PIM2AKR1B1NPC1 | |
| SCHEMBL1299639 | 0.87 | HPGD (1.00) | HPGDPIM1PIM2AKR1B1NPC1 | |
| SCHEMBL1299642 | 0.87 | HPGD (1.00) | HPGDPIM1PIM2AKR1B1NPC1 | |
| SCHEMBL30864156 | 0.85 | HPGD (0.76) | HPGDPIM1PIM2AKR1B1NPC1 | |
| SCHEMBL1291670 | 0.82 | GPR119 (0.67) | HPGDAKR1B1NPC1RAB9A | |
| SCHEMBL1291506 | 0.80 | GPR119 (0.71) | HPGDPIM1PIM2AKR1B1NPC1 | |
| SCHEMBL29029517 | 0.80 | GSK3B (0.57) | HPGDRAB9A | |
| SCHEMBL29029516 | 0.80 | GSK3B (0.57) | HPGDRAB9A | |
| SCHEMBL30440951 | 0.79 | HPGD (0.66) | HPGDPIM1PIM2AKR1B1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118206473-A | Compound, preparation method thereof and application of compound in preparation of sEH inhibitor and PPARs agonist | 沈阳药科大学 | 2024-06-18 | — | — | CN | disclosed |
| CN-118206542-A | Compound, preparation method thereof and application of compound in preparation of sEH inhibitor and PPARs agonist | 沈阳药科大学 | 2024-06-18 | — | — | CN | disclosed |
| CN-118184545-A | Compound, preparation method thereof and application of compound in preparation of sEH inhibitor and PPARs agonist | 沈阳药科大学 | 2024-06-14 | — | — | CN | disclosed |
| CN-116217511-B | Double-target compound, preparation method thereof and application thereof in preparation of sEH inhibitor and PPARs agonist | 沈阳药科大学 | 2024-04-19 | — | — | CN | disclosed |
| CN-116217511-A | Double-target compound, preparation method thereof and application thereof in preparation of sEH inhibitor and PPARs agonist | 沈阳药科大学 | 2023-06-06 | — | — | CN | disclosed |