Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.57 |
| ▸ | CLK4 | Q9HAZ1 | 9/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 2/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | KMO | O15229 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.52 |
| ▸ | AURKA | O14965 | 1/20 | 0.52 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.52 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL15533860 | 0.81 | CLK4 (0.57) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL18650958 | 0.81 | CLK4 (0.58) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL21565688 | 0.78 | CLK4 (0.49) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL21565699 | 0.77 | CLK4 (0.51) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL19596599 | 0.77 | CLK4 (0.51) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL14741834 | 0.76 | KMO (0.57) | CLK4ALDH1A1HSD17B10CYP1A2CYP3A4 | |
| SCHEMBL20380088 | 0.75 | KDM4E (0.59) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL30501033 | 0.75 | KDM4E (0.59) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL14663218 | 0.74 | KMO (0.64) | ADORA2AADORA1CLK4ALDH1A1HSD17B10 | |
| SCHEMBL10187346 | 0.73 | FYN (0.59) | ADORA2AADORA1CLK4ALDH1A1LMNA |
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 |