Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | CBFB | Q13951 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | CCR8 | P51685 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | PPARD | Q03181 | 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 | |
|---|---|---|---|---|
| SCHEMBL2720785 | 0.83 | CBFB (0.37) | TAAR1NPC1HTTPPP1CASMN1; SMN2 | |
| SCHEMBL2719398 | 0.80 | LOXL2 (0.44) | TAAR1HTR2ANPC1HTTPPP1CA | |
| SCHEMBL2720746 | 0.80 | NR1H2 (0.37) | NR4A2HAVCR2CCR1CCR5CCR8 | |
| SCHEMBL2719771 | 0.75 | PIK3CD (0.43) | NR4A2HTR2AHTTSMN1; SMN2TDP1 | |
| SCHEMBL2717467 | 0.74 | PIK3CD (0.41) | — | |
| SCHEMBL16585320 | 0.74 | PIK3CD (0.47) | TAAR1NPC1HTTPPP1CASMN1; SMN2 | |
| SCHEMBL2718747 | 0.74 | FFAR1 (0.36) | TAAR1NPC1HTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL2718687 | 0.71 | METAP2 (0.41) | TAAR1HTR2ANPC1HTTL3MBTL1 | |
| SCHEMBL2720744 | 0.70 | HAVCR2 (0.50) | HAVCR2NR1H2NR1H3PPARGMEN1 | |
| SCHEMBL27852965 | 0.70 | DPP4 (0.53) | TAAR1NPC1HTTPPP1CASMN1; SMN2 |
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 |