Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29133196 | 1.00 | SLC6A2 (0.40) | SLC6A2SLC6A3SLC6A4PRMT5WDR77 | |
| SCHEMBL28949283 | 0.81 | SLC6A2 (0.43) | SLC6A2SLC6A3SLC6A4PRMT5WDR77 | |
| SCHEMBL30622194 | 0.78 | P2RX7 (0.52) | SLC6A2SLC6A3SLC6A4NR1I2NR1I3 | |
| SCHEMBL30622200 | 0.78 | P2RX7 (0.39) | SLC6A2SLC6A3SLC6A4NR1I2NR1I3 | |
| SCHEMBL29133088 | 0.78 | P2RX7 (0.52) | SLC6A2SLC6A3SLC6A4NR1I2NR1I3 | |
| SCHEMBL26654427 | 0.78 | P2RX7 (0.39) | SLC6A2SLC6A3SLC6A4NR1I2NR1I3 | |
| SCHEMBL30622182 | 0.78 | CYP11B1 (0.38) | NR1I2NR1I3P2RX7NOTUMDHODH | |
| SCHEMBL29133075 | 0.78 | CYP11B1 (0.38) | NR1I2NR1I3P2RX7NOTUMDHODH | |
| SCHEMBL16780836 | 0.76 | SLC6A2 (0.53) | SLC6A2SLC6A3SLC6A4PRMT5WDR77 | |
| SCHEMBL29132961 | 0.76 | CLK4 (0.44) | NR1I2NR1I3NOTUMKDM4ENPC1 |
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 |