Alpha-Tocopherol

Alpha-Tocopherol

SCHEMBL28110607

CC(=O)O.Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCCC(C)CCCC(C)CCCC(C)C)O2.O=C(O)CCC(=O)O

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1CDK4CDK6CHRM2CHRM3DPP4DRD2DRD3DRD4EGFRHRH1HTR1BHTR1DHTR1FHTR2AHTR2CHTR4SLC6A2SLC6A4

The experimentally established mechanism targets of Alpha-Tocopherol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.82
TTPA P49638 3/20 0.82
MAPT P10636 2/20 0.82
MEN1 O00255 2/20 0.82
KMT2A Q03164 2/20 0.82
GSTP1 P09211 1/20 0.82
USP2 O75604 1/20 0.82
THRB P10828 1/20 0.82
CYP2C9 P11712 1/20 0.82
CYP2C19 P33261 1/20 0.82
ALOX5 P09917 3/20 0.75
NR1I2 O75469 2/20 0.75
GSTO1 P78417 2/20 0.73
PTPN1 P18031 1/20 0.73
PSEN1 P49768 2/20 0.68
PDE4A P27815 1/20 0.68
PDE3A Q14432 1/20 0.68
AKT1 P31749 2/20 0.49
PDPK1 O15530 1/20 0.49
PHLPP1 O60346 1/20 0.49

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.

Compoundsimilaritytop predictedshared targets
Alpha-Tocopherol SCHEMBL4556023 1.00 LMNA (0.82) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL42939 0.98 LMNA (0.86) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL27995975 0.98 LMNA (0.86) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL28174566 0.96 LMNA (0.89) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL28174565 0.96 LMNA (0.89) LMNATTPAMAPTMEN1KMT2A
Alpha-Tochopherol SCHEMBL1879635 0.96 LMNA (0.89) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL4083978 0.96 LMNA (0.89) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL27177 0.96 LMNA (0.89) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL27538180 0.96 LMNA (0.89) LMNATTPAMAPTMEN1KMT2A
Alpha-Tocopherol SCHEMBL27991376 0.95 LMNA (0.81) LMNATTPAMAPTMEN1KMT2A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106063534-A With more double bonds fat-soluble nutrition high stability micro capsule or powder particle preparation method of 浙江医药股份有限公司新昌制药厂 2016-11-02 CN disclosed