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BDBM67698 2-(4-hydroxyphenyl)-3-[(2S)-2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-3,4-dihydro-2H-chromen-8-yl]-5,7-bis(oxidanyl)chromen-4-one::3-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-1-benzopyran-4-one::3-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one::3-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromone::MLS002472884::SMR001396995::cid_13941113::daphnodorin D2

SMILES: Oc1ccc(cc1)[C@@H]1CCc2c(O)cc(O)c(c2O1)-c1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)cc1

InChI Key: InChIKey=KBUYUAWZPKKJRC-QHCPKHFHSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 67698   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Serine/threonine-protein kinase 33


(Homo sapiens (Human))		BDBM67698
PNG
(2-(4-hydroxyphenyl)-3-[(2S)-2-(4-hydroxyphenyl)-5,...)
Show SMILES Oc1ccc(cc1)[C@@H]1CCc2c(O)cc(O)c(c2O1)-c1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)cc1 |wU:7.7,(4.49,6.07,;4.49,4.53,;3.15,3.76,;3.14,2.22,;4.48,1.45,;5.81,2.21,;5.82,3.75,;4.47,-.09,;3.08,-.9,;3.09,-2.5,;4.49,-3.28,;4.49,-4.82,;3.16,-5.59,;5.83,-5.59,;7.16,-4.82,;8.49,-5.59,;7.16,-3.28,;5.83,-2.51,;5.85,-.91,;8.49,-2.51,;8.49,-.97,;9.83,-.2,;11.16,-.97,;12.54,-.15,;13.93,-.94,;15.26,-.16,;13.93,-2.54,;12.54,-3.33,;12.52,-4.87,;11.16,-2.51,;9.83,-3.28,;9.83,-4.82,;8.49,.57,;9.83,1.34,;9.83,2.88,;8.49,3.65,;8.49,5.19,;7.16,2.88,;7.16,1.34,)|
Show InChI InChI=1S/C30H22O9/c31-16-5-1-14(2-6-16)23-10-9-19-20(34)13-22(36)26(30(19)38-23)27-28(37)25-21(35)11-18(33)12-24(25)39-29(27)15-3-7-17(32)8-4-15/h1-8,11-13,23,31-36H,9-10H2/t23-/m0/s1
KEGG

UniProtKB/SwissProt

antibodypedia
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AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.20E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: STK33 Kinase, Non-ATP Competitive Inhibitor Assay Overview: Purified STK33 Kinase is preincubated with potential inhibitors and allowed to ...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2B27SRF
More data for this
Ligand-Target Pair