Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | PLAT | P00750 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27685979 | 1.00 | CYP1A2 (0.40) | CYP1A2CFTRALDH1A1GAAL3MBTL1 | |
| SCHEMBL27685978 | 0.82 | VCP (0.38) | ALDH1A1IRAK4MEN1KMT2AMAPT | |
| SCHEMBL27680901 | 0.82 | VCP (0.38) | ALDH1A1IRAK4MEN1KMT2AMAPT | |
| SCHEMBL27682787 | 0.82 | CYP1A2 (0.46) | CYP1A2IRAK4MAPTIDO1PLAT | |
| SCHEMBL27680910 | 0.82 | PDE4D (0.38) | PDE4DKDRKDM4E | |
| SCHEMBL27680900 | 0.80 | ABL1 (0.43) | — | |
| SCHEMBL27705032 | 0.80 | ABL1 (0.43) | — | |
| SCHEMBL27680916 | 0.75 | NAMPT (0.39) | — | |
| SCHEMBL27700089 | 0.73 | PIK3CA (0.45) | — | |
| SCHEMBL27682784 | 0.71 | NPC1 (0.41) | CYP1A2ALDH1A1MEN1KMT2AMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101010317-A | 2, 4,6-trisubstituted pyrimidines as phosphotidylinositol (pi) 3-kinase inhibitors and their use in the treatment of cancer | ASTRAZENECA AB (SE) | 2007-08-01 | — | — | CN | disclosed |