Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 17/20 | 0.48 |
| ▸ | PIK3CG | P48736 | 13/20 | 0.48 |
| ▸ | PIK3R2 | O00459 | 4/20 | 0.48 |
| ▸ | PIK3R1 | P27986 | 8/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22237967 | 0.88 | ALDH1A1 (0.50) | PIK3CDPIK3CGPIK3R2KDM4ENPSR1 | |
| SCHEMBL16596152 | 0.86 | PIK3CD (0.47) | PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA | |
| SCHEMBL16596184 | 0.85 | PIK3CD (0.45) | PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA | |
| SCHEMBL16596154 | 0.84 | ALDH1A1 (0.43) | PIK3CDPIK3CGPIK3R1KDM4ENPSR1 | |
| SCHEMBL16596153 | 0.82 | PIK3CD (0.44) | PIK3CDPIK3CGPIK3R2KDM4EALDH1A1 | |
| SCHEMBL14649255 | 0.82 | PIK3CD (0.44) | PIK3CDPIK3CGPIK3R2PIK3R1ABCB11 | |
| SCHEMBL16591273 | 0.82 | PIK3CD (0.54) | PIK3CDPIK3CGPIK3R2PIK3R1ABCB11 | |
| SCHEMBL16596150 | 0.82 | PIK3CD (0.42) | PIK3CDPIK3CGPIK3R1KDM4EALDH1A1 | |
| SCHEMBL16386791 | 0.81 | PIK3CD (0.53) | PIK3CDPIK3CGPIK3R2PIK3R1ABCB11 | |
| SCHEMBL28509792 | 0.81 | TSHR (0.46) | PIK3CDPIK3CGPIK3R2PIK3R1ABCB11 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3312175-A1 | HETEROARYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES ASSOCIATED WITH PI3 KINASES, CONTAINING SAME AS ACTIVE INGREDIENT | Korea Research Institute of Chemical Technology (KR) | 2018-04-25 | — | — | EP | disclosed |
| US-9657007-B2 | Substituted aminopyrimidine compounds and methods of use | CALITOR SCIENCES, LLC (US) | 2017-05-23 | — | — | US | disclosed |
| WO-2015042078-A2 | SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE | CALITOR SCIENCES, LLC (US) | 2015-03-26 | — | — | WO | disclosed |