Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 7/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 7/20 | 0.39 |
| ▸ | MTOR | P42345 | 6/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SCD | O00767 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL3131793 | 0.81 | CHEK1 (0.35) | CHEK1SRCPIK3CAPIK3CGMTOR | |
| SCHEMBL18335244 | 0.74 | METAP1 (0.43) | PIK3CAALDH1A1KDM4EMAPK1PKM | |
| SCHEMBL12614645 | 0.71 | NPC1 (0.39) | ALDH1A1KDM4EPKMLMNATSHR | |
| SCHEMBL27745778 | 0.69 | KDM4E (0.37) | PIK3CAPIK3CGMTORALDH1A1KDM4E | |
| SCHEMBL3128313 | 0.68 | KDM1A (0.33) | ALDH1A1KDM4EMAPK1LMNATSHR | |
| SCHEMBL27745785 | 0.68 | KDM4E (0.34) | PIK3CAPIK3CGMTORALDH1A1KDM4E | |
| SCHEMBL27801283 | 0.68 | HTT (0.39) | ALDH1A1KDM4EMAPK1 | |
| SCHEMBL336706 | 0.68 | PIK3CD (0.50) | CHEK1SRCPIK3CAALDH1A1KDM4E | |
| SCHEMBL9900897 | 0.67 | PKM (0.36) | ALDH1A1KDM4EMAPK1PKMLMNA | |
| SCHEMBL27760171 | 0.64 | KMT2A (0.44) | ALDH1A1MAPK1LMNA |
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-106432239-B | Purine compound, composition and purposes | 大连医科大学 | 2018-10-30 | — | — | CN | disclosed |