Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 9/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL591468 | 0.84 | SMN1; SMN2 (0.61) | PDE4BALOX15MEN1KMT2AMAPT | |
| SCHEMBL1693608 | 0.79 | PDE4B (0.58) | OPRK1PDE4BALOX15MAPTPOLB | |
| SCHEMBL28999429 | 0.78 | CYP2C9 (0.53) | CYP2C9MEN1KMT2AMAPTPOLB | |
| SCHEMBL15321122 | 0.78 | ALOX15 (0.78) | PDE4BALOX15CYP1A2KMT2AMAPT | |
| SCHEMBL16579943 | 0.78 | ALOX15 (0.60) | PDE4BALOX15CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24900590 | 0.75 | ALDH1A1 (0.41) | OPRK1PDE4BALOX15L3MBTL1 | |
| SCHEMBL28999518 | 0.75 | KDM4E (0.58) | CYP1A2CYP2C9CYP2C19KMT2AMAPT | |
| SCHEMBL4503743 | 0.75 | ALOX15 (0.50) | PDE4BALOX15MAPTPOLBGAA | |
| SCHEMBL2681682 | 0.74 | PDE4B (0.49) | PDE4BALOX15 | |
| SCHEMBL4801338 | 0.74 | MAPK1 (0.45) | ALOX15MAPTGAA |
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-2021197467-A1 | MULTI-TARGET ANTI-TUMOR COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海华汇拓医药科技有限公司 | 2021-10-07 | — | — | WO | disclosed |