Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIMK1 | P53667 | 2/20 | 0.54 |
| ▸ | NOS3 | P29474 | 4/20 | 0.35 |
| ▸ | NOS1 | P29475 | 4/20 | 0.35 |
| ▸ | NOS2 | P35228 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.32 |
| ▸ | PI4KA | P42356 | 3/20 | 0.32 |
| ▸ | PI4K2B | Q8TCG2 | 3/20 | 0.32 |
| ▸ | PI4K2A | Q9BTU6 | 3/20 | 0.32 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | HRH2 | P25021 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2738477 | 0.89 | LIMK1 (0.45) | LIMK1HTTNPC1ADKLRRK2 | |
| SCHEMBL2738580 | 0.89 | LIMK1 (0.45) | LIMK1HTTNPC1ADKLRRK2 | |
| SCHEMBL30666554 | 0.79 | LIMK1 (0.40) | LIMK1HTTPOLBL3MBTL1HRH2 | |
| SCHEMBL30667152 | 0.74 | LIMK1 (0.39) | LIMK1NOS3NOS1NOS2HTT | |
| SCHEMBL512854 | 0.73 | HRH3 (0.42) | LIMK1NOS3NOS1NOS2L3MBTL1 | |
| SCHEMBL17690273 | 0.71 | LIMK1 (0.50) | LIMK1NOS3NOS1NOS2HRH2 | |
| SCHEMBL12323859 | 0.70 | LIMK1 (0.33) | LIMK1NOS3NOS1NOS2ADORA2A | |
| SCHEMBL15576293 | 0.70 | LIMK1 (0.33) | LIMK1HTTNPC1ADORA2API4KA | |
| SCHEMBL680907 | 0.68 | LIMK1 (0.33) | LIMK1 | |
| SCHEMBL17771685 | 0.68 | LIMK1 (0.33) | LIMK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2049501-B1 | HYDROXYLATED AND METHOXYLATED CYCLOPENTA [D] PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS | ARRAY BIOPHARMA INC (US) | 2011-09-14 | — | — | EP | disclosed |