Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | CDK8 | P49336 | 1/20 | 0.47 |
| ▸ | CLK2 | P49760 | 1/20 | 0.47 |
| ▸ | GSK3A | P49840 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | CDK9 | P50750 | 1/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.47 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.45 |
| ▸ | GPR68 | Q15743 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2510144 | 0.90 | ADORA1 (0.44) | CDK8ADORA1ADORA2ACYP11B1CYP11B2 | |
| SCHEMBL2505744 | 0.83 | ADORA1 (0.42) | ADORA1ADORA2ACYP11B1CYP11B2 | |
| SCHEMBL2521058 | 0.78 | EGLN2 (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL2507060 | 0.78 | CYP11B2 (0.44) | ADORA1ADORA2ACYP11B1CYP11B2 | |
| SCHEMBL2506224 | 0.78 | PIK3CD (0.46) | ADORA1ADORA2ACYP11B1CYP11B2 | |
| SCHEMBL1317062 | 0.76 | SMN1; SMN2 (0.55) | PRKACACDK8CLK2GSK3AGSK3B | |
| SCHEMBL17403631 | 0.70 | KDM1A (0.49) | CYP11B1CYP11B2 | |
| SCHEMBL1317568 | 0.68 | HRH4 (0.52) | ADORA2ACYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL1427158 | 0.68 | CYP11B2 (0.54) | CYP11B1CYP11B2 | |
| SCHEMBL31276771 | 0.68 | CYP11B2 (0.54) | CYP11B1CYP11B2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2362775-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2011-09-07 | — | — | EP | disclosed |
| WO-2010059658-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-05-27 | — | — | WO | disclosed |