Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL29030555 | 0.85 | NPC1 (0.37) | NPC1RAB9AALDH1A1PDE4APDE4B | |
| SCHEMBL31025948 | 0.83 | GRIN2B (0.55) | GRIN2BLMNAKMT2ACYP2C9 | |
| SCHEMBL25254475 | 0.83 | GRIN2B (0.55) | GRIN2BLMNAKMT2ACYP2C9 | |
| SCHEMBL25818350 | 0.83 | GRIN2B (0.40) | ALDH1A1KDM4EGAAGRIN2BADORA2B | |
| SCHEMBL25299136 | 0.81 | GPR119 (0.43) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL25301684 | 0.81 | NPC1 (0.38) | NPC1RAB9APDE4APDE4BPDE4C | |
| SCHEMBL25294483 | 0.77 | GRIN2B (0.38) | ALDH1A1GRIN2BL3MBTL1ADORA2BKMT2A | |
| SCHEMBL25261415 | 0.73 | RAB9A (0.46) | NPC1RAB9AALDH1A1KDM4EGAA | |
| SCHEMBL25818353 | 0.72 | PDE4A (0.42) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31270804 | 0.72 | KDM4E (0.42) | KDM4EGRIN2BMAPTADORA2BADORA2A |
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-2023125121-A1 | TRICYCLIC COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2023-07-06 | — | — | WO | disclosed |