Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TNIK | Q9UKE5 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CD74 | P04233 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL27086979 | 1.00 | NPC1 (0.38) | NPC1NPSR1ALDH1A1TSHRUSP2 | |
| SCHEMBL25152612 | 1.00 | NPC1 (0.38) | NPC1NPSR1ALDH1A1TSHRUSP2 | |
| SCHEMBL27086852 | 0.88 | NPSR1 (0.37) | NPC1NPSR1ALDH1A1TSHRUSP2 | |
| SCHEMBL25152918 | 0.88 | NPSR1 (0.37) | NPC1NPSR1ALDH1A1TSHRUSP2 | |
| SCHEMBL29919584 | 0.88 | NPSR1 (0.37) | NPC1NPSR1ALDH1A1TSHRUSP2 | |
| SCHEMBL27086834 | 0.82 | ATM (0.35) | NPC1NPSR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL25152477 | 0.82 | ATM (0.35) | NPC1NPSR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29919465 | 0.82 | ATM (0.35) | NPC1NPSR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL32686754 | 0.78 | NPC1 (0.43) | NPC1ALDH1A1MIFSIGMAR1TNIK | |
| SCHEMBL25152956 | 0.76 | NPC1 (0.37) | NPC1ALDH1A1TSHRHPGDMIF |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4320105-A1 | OPIOID RECEPTOR MODULATORS | Epiodyne, Inc. (US) | 2024-02-14 | — | — | EP | disclosed |
| CN-117425644-A | Opioid receptor modulators | 埃皮欧黛公司 | 2024-01-19 | — | — | CN | disclosed |
| WO-2022216750-A1 | OPIOID RECEPTOR MODULATORS | EPIODYNE, INC. (US) | 2022-10-13 | — | — | WO | disclosed |