Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.40 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9953094 | 0.81 | AR (0.33) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL9953164 | 0.78 | CYP17A1 (0.36) | TAAR1DPP4KDM4EADORA2AHSD17B10 | |
| SCHEMBL9929295 | 0.76 | LMNA (0.33) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL9952031 | 0.69 | TAAR1 (0.40) | TAAR1MAOBKDM4EADORA2AHSD17B10 | |
| SCHEMBL9952729 | 0.66 | PIK3CD (0.44) | TAAR1KDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL9952399 | 0.65 | TAAR1 (0.38) | TAAR1 | |
| SCHEMBL9953794 | 0.65 | TAAR1 (0.40) | TAAR1 | |
| SCHEMBL9953176 | 0.64 | LMNA (0.39) | TAAR1MEN1MAPTKMT2AL3MBTL1 | |
| SCHEMBL9953131 | 0.63 | TAAR1 (0.31) | TAAR1 | |
| SCHEMBL2012666 | 0.63 | TAAR1 (0.47) | TAAR1MAOBKMT2AADORA2A |
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 |