Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.45 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.45 |
| ▸ | PI4KA | P42356 | 2/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 3/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | POLA1 | P09884 | 1/20 | 0.33 |
| ▸ | PNP | P00491 | 1/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL2983115 | 0.97 | PDPK1 (0.45) | PDPK1GDAPI4KAPI4K2BPI4K2A | |
| Water SCHEMBL27761338 | 0.96 | PDPK1 (0.44) | PDPK1GDAPI4KAPI4K2BPI4K2A | |
| SCHEMBL7638547 | 0.85 | PDPK1 (0.41) | PDPK1GDAPI4KAPI4K2BPI4K2A | |
| SCHEMBL2117124 | 0.79 | ADORA2A (0.34) | ADORA2AADORA1ADK | |
| SCHEMBL29383125 | 0.79 | ADORA2A (0.34) | ADORA2AADORA1ADK | |
| SCHEMBL27595472 | 0.77 | PDPK1 (0.40) | PDPK1GDAPI4KAPI4K2BPI4K2A | |
| SCHEMBL2983106 | 0.76 | ADORA2A (0.34) | ADORA2AADORA1PNPADK | |
| SCHEMBL28530829 | 0.75 | PDPK1 (0.41) | PDPK1GDAPI4KAPI4K2BPI4K2A | |
| 2,6-Diaminopurine SCHEMBL443468 | 0.75 | PDPK1 (0.55) | PDPK1GDACDK2DPP4ADORA2A | |
| SCHEMBL2010793 | 0.74 | PDPK1 (0.43) | PDPK1GDALMNAKDRAURKB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130030007-A1 | Obesity Small Molecules | AKRON MOLECULES GMBH (AT) | 2013-01-31 | — | — | US | disclosed |
| EP-2521594-A2 | OBESITY SMALL MOLECULES | Akron Molecules GmbH (AT) | 2012-11-14 | — | — | EP | disclosed |
| US-20120094947-A1 | METHOD FOR THE SELECTIVE THERAPY OF DISEASE | LUBIN ADAM (US) | 2012-04-19 | — | — | US | disclosed |
| WO-2011083150-A2 | OBESITY SMALL MOLECULES | AKRON MOLECULES GMBH (AT) | 2011-07-14 | — | — | WO | disclosed |
| EP-2192905-A2 | METHOD FOR THE SELECTIVE THERAPY OF DISEASE | Lubin, Adam (US) | 2010-06-09 | — | — | EP | disclosed |
| WO-2009032057-A2 | METHOD FOR THE SELECTIVE THERAPY OF DISEASE | LUBIN ADAM (US) | 2009-03-12 | — | — | WO | disclosed |