Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K11 | Q16584 | 4/20 | 0.52 |
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | AHR | P35869 | 1/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.47 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.47 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.47 |
| ▸ | CLK1 | P49759 | 1/20 | 0.47 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.45 |
| ▸ | PIP4K2B | P78356 | 1/20 | 0.45 |
| ▸ | GUSB | P08236 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19391087 | 0.80 | DYRK1B (0.47) | MAP3K11LRRK2NPC1AHRDYRK1A | |
| SCHEMBL14365330 | 0.76 | MAP3K11 (0.67) | MAP3K11LRRK2NPC1DYRK1ADYRK2 | |
| SCHEMBL5850255 | 0.75 | NPC1 (0.79) | MAP3K11BRD4NPC1AHRGUSB | |
| SCHEMBL16881490 | 0.74 | BRD4 (0.47) | LRRK2BRD4DYRK1ADYRK2DYRK1B | |
| SCHEMBL20261213 | 0.74 | ABL1 (0.49) | CHRNA7KCNH2ABL1 | |
| SCHEMBL13354456 | 0.74 | PIP4K2A (0.58) | MAP3K11LRRK2BRD4NPC1DYRK1A | |
| SCHEMBL857265 | 0.73 | RIPK1 (0.57) | LRRK2BRD4DYRK1ADYRK1BPIK3CD | |
| SCHEMBL12680497 | 0.73 | NPC1 (0.56) | MAP3K11LRRK2NPC1AHRDYRK1A | |
| SCHEMBL21250701 | 0.73 | NPC1 (0.60) | MAP3K11LRRK2NPC1DYRK1ADYRK2 | |
| SCHEMBL29475133 | 0.72 | BRD4 (0.48) | MAP3K11LRRK2BRD4NPC1AHR |
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-2012001107-A1 | PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |