Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 1/20 | 0.34 |
| ▸ | NPY2R | P49146 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | GUSB | P08236 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.33 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30622182 | 1.00 | CYP11B1 (0.38) | CYP11B1CYP11B2NR1I2NR1I3MAPT | |
| SCHEMBL30622232 | 0.78 | SLC6A2 (0.40) | NR1I2NR1I3NOTUMP2RX7DHODH | |
| SCHEMBL29133196 | 0.78 | SLC6A2 (0.40) | NR1I2NR1I3NOTUMP2RX7DHODH | |
| SCHEMBL30622194 | 0.76 | P2RX7 (0.52) | NR1I2NR1I3MAPTNOTUMP2RX7 | |
| SCHEMBL5780833 | 0.76 | CASP1 (0.44) | CYP11B1CYP11B2MAPTCASP1GRIN1 | |
| SCHEMBL29133088 | 0.76 | P2RX7 (0.52) | NR1I2NR1I3MAPTNOTUMP2RX7 | |
| SCHEMBL26654427 | 0.73 | P2RX7 (0.39) | NR1I2NR1I3MAPTNOTUMP2RX7 | |
| SCHEMBL30622200 | 0.73 | P2RX7 (0.39) | NR1I2NR1I3MAPTNOTUMP2RX7 | |
| SCHEMBL24252449 | 0.72 | SLC6A4 (0.46) | CYP11B1CYP11B2MAPTTUBB4ATUBB | |
| SCHEMBL29133194 | 0.72 | CYP2D6 (0.44) | CYP11B1CYP11B2P2RX7PIK3CAPIK3CB |
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 |