Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 1/20 | 0.52 |
| ▸ | BLK | P51451 | 1/20 | 0.50 |
| ▸ | NSD2 | O96028 | 1/20 | 0.49 |
| ▸ | ACLY | P53396 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29494507 | 0.91 | BLK (0.52) | CLK1BLKNSD2ACLYMEN1 | |
| SCHEMBL29494461 | 0.89 | BLK (0.50) | CLK1BLKNSD2ACLYMEN1 | |
| SCHEMBL29494528 | 0.85 | BLK (0.47) | BLKNSD2ACLYMEN1KMT2A | |
| SCHEMBL29494530 | 0.75 | NPC1 (0.51) | MEN1KMT2ASMN1; SMN2BCHEKCNH2 | |
| SCHEMBL3235212 | 0.74 | MTNR1A (0.54) | MEN1KMT2A | |
| SCHEMBL29494496 | 0.72 | MAPT (0.50) | MEN1KMT2ASMN1; SMN2ADORA1ALDH1A1 | |
| SCHEMBL23715750 | 0.70 | ALDH1A1 (0.61) | CLK1MEN1KMT2ASMN1; SMN2MAPK8 | |
| SCHEMBL30874538 | 0.70 | MEN1 (0.54) | NSD2MEN1KMT2ASMN1; SMN2CYP2C9 | |
| SCHEMBL29191075 | 0.70 | MEN1 (0.54) | NSD2MEN1KMT2ASMN1; SMN2CYP2C9 | |
| SCHEMBL27382838 | 0.68 | ADORA2A (0.61) | ADORA2AADORA1 |
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 |