Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 3/20 | 0.36 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29133064 | 0.84 | NOTUM (0.43) | KDM4EKMT2AHSD17B10NPC1RAB9A | |
| SCHEMBL29133160 | 0.84 | SMN1; SMN2 (0.41) | KDM4EKMT2AHSD17B10NPC1RAB9A | |
| SCHEMBL30622248 | 0.82 | KDM4E (0.49) | KDM4EKMT2AHSD17B10NPC1RAB9A | |
| SCHEMBL29133117 | 0.80 | HDAC6 (0.45) | — | |
| SCHEMBL29133055 | 0.79 | ALDH1A1 (0.52) | KDM4EMAPTTP53ALDH1A1PIM1 | |
| SCHEMBL30622193 | 0.79 | TLR8 (0.43) | KDM4EKMT2AHSD17B10NPC1RAB9A | |
| SCHEMBL29133097 | 0.76 | ALDH1A1 (0.52) | KDM4ENPC1RAB9ANOTUMMAPT | |
| SCHEMBL792274 | 0.75 | PTPN1 (0.36) | KDM4ENPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL29133133 | 0.74 | SMN1; SMN2 (0.36) | KDM4EKMT2AHSD17B10NPC1RAB9A | |
| SCHEMBL29133007 | 0.74 | MAPT (0.48) | KMT2ARAB9ASMN1; SMN2MAPTTP53 |
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-117088884-A | Imidazopyridazine derivatives as GABAA receptor modulators, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-21 | — | — | CN | disclosed |