Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 12/20 | 0.35 |
| ▸ | CDK9 | P50750 | 12/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | POLQ | O75417 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | CDK7 | P50613 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23732242 | 0.69 | RECQL (0.45) | GPBAR1SCN9APOLQPIK3CA | |
| SCHEMBL28582907 | 0.69 | CDK2 (0.40) | GPBAR1SCN9AWDR5POLQCDK2 | |
| SCHEMBL30827972 | 0.69 | CDK2 (0.40) | GPBAR1SCN9AWDR5POLQCDK2 | |
| SCHEMBL12093598 | 0.66 | PIK3CA (0.44) | PIK3CA | |
| SCHEMBL15472079 | 0.66 | PIK3CA (0.41) | PIK3CA | |
| SCHEMBL17821115 | 0.66 | GPBAR1 (0.36) | GPBAR1SCN9AWDR5POLQPIK3CA | |
| SCHEMBL12093713 | 0.64 | AGBL2 (0.42) | GPBAR1POLQPIK3CA | |
| SCHEMBL15150582 | 0.64 | P2RX3 (0.35) | GPBAR1SCN9APOLQPIK3CA | |
| SCHEMBL2004849 | 0.64 | CIT (0.41) | GPBAR1SCN9APIK3CA | |
| SCHEMBL933336 | 0.63 | S100A9 (0.36) | GPBAR1POLQPIK3CA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112979654-B | Heteroaryl fused ring compounds, preparation method and application thereof | 赛诺哈勃药业（成都）有限公司 | 2024-03-19 | — | — | CN | disclosed |