Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9952322 | 0.91 | SMN1; SMN2 (0.38) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| Hydrochloric Acid SCHEMBL9952456 | 0.90 | SMN1; SMN2 (0.37) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL9952761 | 0.84 | IMPDH2 (0.37) | HTR2AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL9929204 | 0.84 | PDE4B (0.43) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL9928732 | 0.83 | PDE4B (0.41) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL14742321 | 0.83 | SMN1; SMN2 (0.38) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL14742531 | 0.83 | SMN1; SMN2 (0.38) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL9952952 | 0.82 | PDE4B (0.36) | PDE4BMEN1KMT2ATP53KDM4E | |
| SCHEMBL9929491 | 0.77 | PIK3CD (0.39) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL9929014 | 0.77 | PRMT5 (0.39) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 |
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-2655374-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | Incyte Corporation (US) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012087881-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2012-06-28 | — | — | WO | disclosed |