Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RNASEH1 | O60930 | 1/20 | 0.47 |
| ▸ | DAO | P14920 | 9/20 | 0.46 |
| ▸ | DDO | Q99489 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TYR | P14679 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MDM4 | O15151 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9388968 | 0.88 | KIF11 (0.49) | RNASEH1DAODDOKDM4ETYR | |
| SCHEMBL9387632 | 0.79 | DAO (0.65) | DAODDOKDM4EALDH1A1MAPT | |
| SCHEMBL9388969 | 0.78 | DAO (0.41) | DAODDO | |
| SCHEMBL10650676 | 0.78 | KDM4E (0.54) | RNASEH1KDM4EGAATYRALDH1A1 | |
| SCHEMBL38650847 | 0.78 | KDM4E (0.54) | RNASEH1KDM4EGAATYRALDH1A1 | |
| SCHEMBL9389777 | 0.76 | DAO (0.65) | DAODDOKDM4EGAAALDH1A1 | |
| SCHEMBL9007825 | 0.76 | DAO (0.65) | DAOKDM4EGAAALDH1A1MAPT | |
| SCHEMBL9387730 | 0.76 | HPGD (0.60) | DAODDOKDM4EALDH1A1MAPT | |
| SCHEMBL9393070 | 0.75 | DAO (0.63) | DAODDOKDM4EALDH1A1MAPT | |
| SCHEMBL7030965 | 0.73 | KDM4E (0.50) | KDM4EGAAALDH1A1MAPTHTT |
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-1994007500-A1 | 2,5-DIHYDRO-2,5-DIOXO-1H-AZEPINES AND 2,5-DIHYDRO-2-OXO-1H-AZEPINES AND THE USE THEREOF AS EXCITATORY AMINO ACID AND GLYCINE RECEPTOR ANTAGONISTS | WEBER ECKARD (US) | 1994-04-14 | — | — | WO | disclosed |