Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GPR3 | P46089 | 1/20 | 0.42 |
| ▸ | NCF1 | P14598 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | TOP2A | P11388 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.34 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.33 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15064194 | 1.00 | KDM4E (0.42) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL25666734 | 0.85 | KDM4E (0.42) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL1859512 | 0.77 | KDM4E (0.43) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL25666728 | 0.74 | KDM4E (0.39) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL25666751 | 0.74 | KDM4E (0.39) | KDM4EGPR3NCF1ADRB2LOXL2 | |
| SCHEMBL11880018 | 0.74 | KDM4E (0.36) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL12406712 | 0.72 | KDM4E (0.44) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL1770055 | 0.69 | KDM4E (0.41) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL30972078 | 0.68 | GPR3 (0.48) | KDM4EGPR3NCF1CYP1A2ADRB2 | |
| SCHEMBL11258247 | 0.68 | GPR3 (0.40) | KDM4EGPR3NCF1LOXL2PDPK1 |
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-2022161420-A1 | CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翊石医药科技有限公司 | 2022-08-04 | — | — | WO | disclosed |