Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 6/20 | 0.61 |
| ▸ | CLK1 | P49759 | 1/20 | 0.61 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.58 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.57 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.57 |
| ▸ | CDK7 | P50613 | 1/20 | 0.55 |
| ▸ | ABL1 | P00519 | 2/20 | 0.54 |
| ▸ | BCR | P11274 | 2/20 | 0.54 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.54 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.54 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | CLK2 | P49760 | 2/20 | 0.54 |
| ▸ | CLK3 | P49761 | 2/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | JAK2 | O60674 | 1/20 | 0.52 |
| ▸ | JAK1 | P23458 | 1/20 | 0.52 |
| ▸ | WNT1 | P04628 | 2/20 | 0.52 |
| ▸ | ITK | Q08881 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29172502 | 1.00 | DYRK1A (0.61) | DYRK1ACLK1LRRK2CYP11B1CYP11B2 | |
| SCHEMBL30725877 | 0.90 | CDK7 (0.67) | DYRK1ALRRK2CDK7NTRK1CLK2 | |
| SCHEMBL29172495 | 0.90 | CDK7 (0.67) | DYRK1ALRRK2CDK7NTRK1CLK2 | |
| SCHEMBL29172484 | 0.89 | PDPK1 (0.64) | DYRK1ALRRK2CDK7NTRK1NPC1 | |
| SCHEMBL30725844 | 0.89 | PDPK1 (0.64) | DYRK1ALRRK2CDK7NTRK1NPC1 | |
| SCHEMBL5394136 | 0.89 | LRRK2 (0.57) | DYRK1ACLK1LRRK2CYP11B1CYP11B2 | |
| SCHEMBL29172497 | 0.89 | LRRK2 (0.58) | DYRK1ALRRK2CDK7CLK2CLK3 | |
| SCHEMBL30725869 | 0.89 | LRRK2 (0.58) | DYRK1ALRRK2CDK7CLK2CLK3 | |
| SCHEMBL5381989 | 0.87 | AURKA (0.60) | LRRK2NPC1RAB9AAURKAJAK2 | |
| SCHEMBL30725866 | 0.86 | LRRK2 (0.70) | LRRK2CYP11B1CYP11B2ABL1BCR |
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-117186066-A | Indazole ALK5 inhibitor and preparation method and application thereof | 中国药科大学 | 2023-12-08 | — | — | CN | disclosed |