Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2719830 | 0.88 | LOXL2 (0.42) | ADORA2ATAAR1L3MBTL1KDM4ECYP1A2 | |
| SCHEMBL2721157 | 0.83 | HTR2A (0.40) | TAAR1KDM4EHTTALDH1A1MAPT | |
| SCHEMBL2719398 | 0.77 | LOXL2 (0.44) | TAAR1L3MBTL1KDM4ECYP1A2CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL2249315 | 0.76 | ADORA2A (0.46) | PRKAA2ADORA2AL3MBTL1KDM4ECYP1A2 | |
| SCHEMBL2720807 | 0.74 | TAAR1 (0.42) | MAOBTAAR1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2718687 | 0.73 | METAP2 (0.41) | TAAR1L3MBTL1HTTLMNAALDH1A1 | |
| SCHEMBL2720297 | 0.73 | ALDH1A1 (0.45) | ADORA2AKDM4ECYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2720617 | 0.73 | PIK3CD (0.44) | CYP3A4HTTLMNA | |
| SCHEMBL2721133 | 0.72 | ADORA2A (0.40) | PRKAA2ADORA2AL3MBTL1KDM4ECYP1A2 | |
| SCHEMBL28284586 | 0.71 | ERN1 (0.43) | PRKAA2ADORA2AKDM4ELMNATP53 |
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-2635565-A1 | 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS | Amgen Inc. (US) | 2013-09-11 | — | — | EP | disclosed |
| WO-2012061696-A1 | 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS | AMGEN INC. (US) | 2012-05-10 | — | — | WO | disclosed |