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SMILES: OC(=O)[C@@H]1CCC=C(C[C@]11Oc2ccc(O)cc2C1=O)C=O

InChI Key: InChIKey=TWZIYFUINRYVHC-LRDDRELGSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50235328   
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
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50235328
PNG
(CHEMBL4089667)
Show SMILES OC(=O)[C@@H]1CCC=C(C[C@]11Oc2ccc(O)cc2C1=O)C=O |r,c:6|
Show InChI InChI=1S/C16H14O6/c17-8-9-2-1-3-12(15(20)21)16(7-9)14(19)11-6-10(18)4-5-13(11)22-16/h2,4-6,8,12,18H,1,3,7H2,(H,20,21)/t12-,16-/m0/s1
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Article
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged JAK3 cytoplasmic domain (781 to 1124 residues) expressed in baculovirus expression system incubated for 1 ...

J Nat Prod 80: 61-70 (2017)


Article DOI: 10.1021/acs.jnatprod.6b00431
BindingDB Entry DOI: 10.7270/Q2CV4M0M
More data for this
Ligand-Target Pair