Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.64 |
| ▸ | DDO | Q99489 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.57 |
| ▸ | HPGD | P15428 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9392742 | 0.89 | DAO (0.52) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL9387738 | 0.86 | DAO (0.65) | DAOALDH1A1DDOKDM4ELMNA | |
| SCHEMBL9389777 | 0.79 | DAO (0.65) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL9007825 | 0.79 | DAO (0.65) | DAOALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL9387730 | 0.79 | HPGD (0.60) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL9393070 | 0.79 | DAO (0.63) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL9387807 | 0.79 | RNASEH1 (0.47) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL7352458 | 0.79 | DAO (0.53) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL16767844 | 0.79 | DAO (1.00) | DAOALDH1A1DDOKDM4EHPGD | |
| SCHEMBL4791757 | 0.78 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDNPC1RAB9A |
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 |