Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 9/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | ABL2 | P42684 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28559488 | 0.81 | SMN1; SMN2 (0.50) | SMN1; SMN2KDM4EALDH1A1EGFRPARP1 | |
| SCHEMBL28549389 | 0.81 | SMN1; SMN2 (0.50) | SMN1; SMN2KDM4EALDH1A1EGFRPARP1 | |
| SCHEMBL31447943 | 0.79 | SMN1; SMN2 (0.49) | SMN1; SMN2KDM4EALDH1A1EGFRABL1 | |
| SCHEMBL11843637 | 0.77 | KDM4E (0.47) | SMN1; SMN2KDM4EALDH1A1EGFRF2 | |
| SCHEMBL11163975 | 0.77 | ALDH1A1 (0.47) | SMN1; SMN2KDM4EALDH1A1EGFRALOX15 | |
| SCHEMBL25423026 | 0.77 | NISCH (0.57) | KDM4EALOX15HSD17B10PARP1 | |
| SCHEMBL28874663 | 0.74 | MAPT (0.47) | SMN1; SMN2KDM4EALDH1A1EGFRABL1 | |
| SCHEMBL4101907 | 0.73 | HTR2C (0.54) | SMN1; SMN2KDM4EALDH1A1EGFRMAPK1 | |
| SCHEMBL10736375 | 0.73 | MAPT (0.59) | SMN1; SMN2KDM4EALDH1A1PARP1TNKS2 | |
| SCHEMBL2485381 | 0.72 | GFER (0.60) | SMN1; SMN2KDM4EALDH1A1EGFRALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3315500-A1 | FUSED TETRA OR PENTA-CYCLIC DIHYDRODIAZEPINOCARBAZOLONES AS PARP INHIBITORS | BeiGene, Ltd. (KY) | 2018-05-02 | — | — | EP | disclosed |