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SMILES: COc1ccc(C(=O)\C=C\c2ccc(O)c(F)c2)c(OC)c1OC

InChI Key: InChIKey=PREWOCGJBXHGRJ-QPJJXVBHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50176886   
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
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))		BDBM50176886
PNG
(CHEMBL3813743)
Show SMILES COc1ccc(C(=O)\C=C\c2ccc(O)c(F)c2)c(OC)c1OC
Show InChI InChI=1S/C18H17FO5/c1-22-16-9-6-12(17(23-2)18(16)24-3)14(20)7-4-11-5-8-15(21)13(19)10-11/h4-10,21H,1-3H3/b7-4+
PDB
MMDB

NCI pathway
KEGG

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PubMed
 2.80E+4n/an/an/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Binding affinity to PEST and transmembrane regions lacking N-terminal His6/MBP-tagged human MCl1 (172 to 327 residues) expressed in Escherichia coli ...

J Med Chem 59: 4152-70 (2016)


BindingDB Entry DOI: 10.7270/Q2TX3H9R
More data for this
Ligand-Target Pair