Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | F13A1 | P00488 | 1/20 | 0.37 |
| ▸ | TGM2 | P21980 | 1/20 | 0.37 |
| ▸ | TGM1 | P22735 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9952456 | 0.99 | SMN1; SMN2 (0.37) | SMN1; SMN2CYP2C19PTGDR2NPC1RAB9A | |
| SCHEMBL14742531 | 0.92 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP2C19PTGDR2NPC1RAB9A | |
| SCHEMBL14742321 | 0.92 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP2C19PTGDR2NPC1RAB9A | |
| SCHEMBL9952815 | 0.91 | PDE4B (0.41) | SMN1; SMN2CYP2C19PTGDR2NPC1RAB9A | |
| SCHEMBL9954419 | 0.85 | PDE4B (0.41) | SMN1; SMN2CHRM4PDE4BSIGMAR1 | |
| SCHEMBL9929491 | 0.85 | PIK3CD (0.39) | SMN1; SMN2CYP2C19NPC1RAB9AKDM4E | |
| SCHEMBL9929014 | 0.84 | PRMT5 (0.39) | SMN1; SMN2CYP2C19PTGDR2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL9928983 | 0.84 | PIK3CD (0.39) | SMN1; SMN2CYP2C19NPC1RAB9AKDM4E | |
| SCHEMBL14735982 | 0.84 | PDE4B (0.41) | SMN1; SMN2CYP2C19PTGDR2NPC1RAB9A | |
| SCHEMBL14735979 | 0.84 | GLRA1 (0.41) | SMN1; SMN2NPC1RAB9AOPRK1CHRM4 |
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 |