Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | CASP3 | P42574 | 2/20 | 0.33 |
| ▸ | CASP4 | P49662 | 2/20 | 0.33 |
| ▸ | CASP7 | P55210 | 2/20 | 0.33 |
| ▸ | CASP9 | P55211 | 2/20 | 0.33 |
| ▸ | CASP6 | P55212 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CRYZ | Q08257 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PITRM1 | Q5JRX3 | 1/20 | 0.32 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27934603 | 0.91 | L3MBTL1 (0.37) | ALDH1A1L3MBTL1GAAMEN1KMT2A | |
| SCHEMBL27590551 | 0.81 | GRIA1 (0.31) | — | |
| SCHEMBL27609187 | 0.80 | CREBBP (0.34) | — | |
| SCHEMBL27590539 | 0.80 | GSK3B (0.33) | ALDH1A1 | |
| SCHEMBL27590506 | 0.78 | NPC1 (0.32) | SMN1; SMN2LMNA | |
| SCHEMBL27608930 | 0.74 | NPC1 (0.32) | SMN1; SMN2LMNA | |
| SCHEMBL27799201 | 0.73 | SIRT2 (0.40) | ALDH1A1L3MBTL1GAAMEN1KMT2A | |
| SCHEMBL27608978 | 0.73 | TSHR (0.36) | ALDH1A1L3MBTL1GAAMEN1KMT2A | |
| SCHEMBL27590541 | 0.73 | NISCH (0.32) | MAPT | |
| SCHEMBL27608922 | 0.69 | NPC1 (0.33) | SMN1; SMN2LMNA |
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-101535276-B | 2, 4-diaminopyrimidine fused bicyclic derivatives as ALK and c-MET inhibitors | CEPHALON INC | 2013-08-28 | — | — | CN | disclosed |