Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADA | P00813 | 3/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 8/20 | 0.35 |
| ▸ | DAGLA | Q9Y4D2 | 5/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15640158 | 1.00 | ADA (0.39) | ADANR1I2TLR8CYP1A2CYP2C9 | |
| SCHEMBL30020799 | 1.00 | ADA (0.39) | ADANR1I2TLR8CYP1A2CYP2C9 | |
| SCHEMBL19779926 | 0.84 | TLR8 (0.38) | ADATLR8CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29814520 | 0.79 | ADA (0.39) | ADANR1I2TLR8FAAHDAGLA | |
| SCHEMBL29882503 | 0.77 | HPGD (0.43) | NR1I2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL26041690 | 0.76 | FAAH (0.37) | NR1I2TLR8FAAHDAGLA | |
| SCHEMBL21888617 | 0.76 | FAAH (0.37) | NR1I2TLR8FAAHDAGLA | |
| Hydrochloric Acid SCHEMBL29882270 | 0.75 | HPGD (0.42) | NR1I2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL26546032 | 0.75 | NR1I2 (0.41) | NR1I2FAAHDAGLA | |
| SCHEMBL23870976 | 0.75 | FAAH (0.36) | NR1I2FAAHDAGLA |
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-110225912-B | GSK-3 inhibitors | 百时美施贵宝公司 | 2022-10-21 | — | — | CN | disclosed |