Home | Screening data | Screen comparisons | Search for compounds | Structure search

Compound InformationSONAR Target prediction
Name:

MYRICETIN

Unique Identifier:SPE01504065
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H10O8
Molecular Weight:308.156 g/mol
X log p:9.93000000000001  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:1
Canonical Smiles:Oc1cc(O)c2C(=O)C(O)=C(Oc2c1)c1cc(O)c(O)c(O)c1
Source:ex Myrica spp
Reference:J Chem Soc 81: 203 (1902); PNAS 97: 4790 (2000)
Therapeutics:antiHIV, topoisomerase II inhibitor
Generic_name:2-(3,4,5-TRIHYDROXYPHENYL)-3,5,7-TRIHYDR
Chemical_iupac_name:3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE
Drug_type:Experimental
Drugbank_id:EXPT02265
Drug_category:Phosphatidylinositol 3-Kinase Catalytic Subu inhibitor
Organisms_affected:-1

Found: 101 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [101]
Species: 4932
Condition: BRE1
Replicates: 2
Raw OD Value: r im 0.4725±0.0200111
Normalized OD Score: sc h 1.0123±0.0104022
Z-Score: 0.2275±0.198635
p-Value: 0.821778
Z-Factor: -4.98212
Fitness Defect: 0.1963
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:10|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2006-03-16 YYYY-MM-DD
Plate CH Control (+):0.039625±0.00160
Plate DMSO Control (-):0.4627±0.01045
Plate Z-Factor:0.9104
png
ps
pdf

DBLink | Rows returned: 3
5280343 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chromen-4-one
5281672 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
5284452 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chromen-4-one dihydrate

internal high similarity DBLink | Rows returned: 12<< Back 1 2
SPE00310031 0.9820
SPE01502247 0.9878
SPE01500672 1.0000
LOPAC 01176 1.0000
LOPAC 01061 1.0000
XBX 00307 1.0000

active | Cluster 10732 | Additional Members: 22 | Rows returned: 82 Next >> 
RJC 00213 0.508196721311475
SPE01505143 0.464285714285714
SPE01502259 0.421052631578947
Prest342 0.326923076923077
LOPAC 01061 0.326923076923077
Prest1133 0.224489795918367

Service provided by the Mike Tyers Laboratory