Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLK | P51451 | 2/20 | 0.47 |
| ▸ | KCNB1 | Q14721 | 6/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ACLY | P53396 | 1/20 | 0.41 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29494461 | 0.87 | BLK (0.50) | BLKKCNB1KCNH2NSD2ADORA2A | |
| SCHEMBL29494507 | 0.86 | BLK (0.52) | BLKKCNB1KCNH2NSD2ADORA2A | |
| SCHEMBL29494537 | 0.85 | CLK1 (0.52) | BLKKCNB1KCNH2NSD2ADORA2A | |
| SCHEMBL29494565 | 0.79 | KCNB1 (0.46) | KCNB1KCNH2SMN1; SMN2KCNA5BCHE | |
| SCHEMBL29494485 | 0.77 | KCNH2 (0.45) | KCNB1KCNH2ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL29494549 | 0.76 | KLKB1 (0.49) | KCNB1KCNH2LMNAMAPTHPGD | |
| SCHEMBL29494545 | 0.74 | BLK (0.43) | BLK | |
| SCHEMBL29494232 | 0.74 | HSD17B10 (0.58) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL29494470 | 0.72 | METTL3 (0.43) | KCNB1KCNH2SMN1; SMN2KCNA5BCHE | |
| SCHEMBL29494285 | 0.70 | — | — |
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 |