Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNB1 | Q14721 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29494485 | 0.88 | KCNH2 (0.45) | KCNB1KCNH2NPC1RAB9AMAPT | |
| SCHEMBL29494547 | 0.86 | RAB9A (0.48) | KCNB1KCNH2NPC1RAB9AMAPT | |
| SCHEMBL29494447 | 0.86 | MAPT (0.50) | KCNB1KCNH2NPC1RAB9AMAPT | |
| SCHEMBL29494530 | 0.85 | NPC1 (0.51) | KCNB1KCNH2NPC1RAB9AMAPT | |
| Trifluoroacetic Acid SCHEMBL29494303 | 0.82 | KCNB1 (0.41) | KCNB1KCNH2NPC1RAB9AMAPT | |
| SCHEMBL29494549 | 0.82 | KLKB1 (0.49) | KCNB1KCNH2MAPTHPGDLMNA | |
| SCHEMBL29494528 | 0.79 | BLK (0.47) | KCNB1KCNH2MAPTALDH1A1KDM4E | |
| SCHEMBL29494503 | 0.73 | HDAC1 (0.44) | NPC1RAB9AALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL29494552 | 0.73 | ADORA2A (0.43) | KCNB1KCNH2NPC1RAB9AMAPT | |
| SCHEMBL29494470 | 0.73 | METTL3 (0.43) | KCNB1KCNH2MAPTKDM4ESMN1; SMN2 |
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-2022070048-A1 | NOVEL AMIDE DERIVATIVES | CADILA HEALTHCARE LIMITED (IN) | 2022-04-07 | — | — | WO | disclosed |