Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 13/20 | 1.00 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | CASP2 | P42575 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | CASP6 | P55212 | 1/20 | 0.55 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.55 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11413881 | 0.89 | CASP3 (0.79) | CASP3POLBRXFP1MEN1KMT2A | |
| SCHEMBL12857607 | 0.82 | CASP3 (1.00) | CASP3POLBRXFP1GAAHSD17B10 | |
| SCHEMBL22033199 | 0.82 | CASP3 (0.69) | CASP3POLBRXFP1MEN1KMT2A | |
| SCHEMBL12857945 | 0.79 | CASP3 (1.00) | CASP3POLBMEN1KMT2AGAA | |
| SCHEMBL12857798 | 0.79 | POLB (0.87) | CASP3POLBRXFP1KCNMA1 | |
| SCHEMBL12857851 | 0.77 | CASP3 (1.00) | CASP3POLBMEN1KMT2AGAA | |
| SCHEMBL11831378 | 0.77 | CASP3 (0.62) | CASP3POLBRXFP1MEN1KMT2A | |
| SCHEMBL12368122 | 0.77 | KMT2A (0.79) | RXFP1MEN1KMT2ATSHRGAA | |
| SCHEMBL12857522 | 0.76 | CASP3 (1.00) | CASP3POLBMEN1KMT2AGAA | |
| SCHEMBL4585562 | 0.76 | CASP3 (0.61) | CASP3KMT2ATSHRGAAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7683073-B2 | Isoquinoline-1,3,4-trione compounds, the synthetic method and the use thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2010-03-23 | — | — | US | disclosed |
| US-7683073-B2 | Isoquinoline-1,3,4-trione compounds, the synthetic method and the use thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2010-03-23 | — | — | US | disclosed |