SCHEMBL27994530

SCHEMBL27994530

NO[PH](=O)OC1C=Cc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.34
HTR6 P50406 1/20 0.34
CYP2D6 P10635 1/20 0.30

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
SCHEMBL30863700 0.70 HTR2A (0.37) HTR2AHTR6
SCHEMBL1680358 0.69 HTR2A (0.38) HTR2AHTR6CYP2D6
SCHEMBL1680359 0.69 RET (0.38) HTR2AHTR6CYP2D6
SCHEMBL7197990 0.69 HTR2A (0.38) HTR2AHTR6CYP2D6
SCHEMBL5150447 0.69 HTR2A (0.38) HTR2AHTR6CYP2D6
SCHEMBL63929 0.68 HTR2A (0.34) HTR2AHTR6CYP2D6
SCHEMBL6700611 0.68 POLB (0.39) HTR2AHTR6CYP2D6
SCHEMBL5370598 0.68 HTR2A (0.34) HTR2AHTR6CYP2D6
SCHEMBL30931450 0.67 POLB (0.38) HTR2AHTR6CYP2D6
SCHEMBL29723819 0.66 SLC6A2 (0.38) HTR2AHTR6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104357480-B Turn the method that RgPAL1 genes improve acteoside content in glutinous rehmannia 安徽工业大学 2017-09-19 CN disclosed
CN-104357480-A Method for improving content of verbascoside in rehmannia by virtue of transformation of RgPAL1 gene UNIV ANHUI TECHNOLOGY 2015-02-18 CN disclosed