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BDBM50537181 CHEMBL4522192

SMILES: COc1cc(c(OC)cn1)C(O)(CCN(C)C)C(c1cccc(OC)c1F)c1cc2cc(Br)ccc2nc1OC

InChI Key: InChIKey=CMBKOLOWRXXJAQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50537181   
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
1,3-beta-glucan synthase component GLS2


(Saccharomyces cerevisiae)
BDBM50537181
PNG
(CHEMBL4522192)
Show SMILES COc1cc(c(OC)cn1)C(O)(CCN(C)C)C(c1cccc(OC)c1F)c1cc2cc(Br)ccc2nc1OC
Show InChI InChI=1S/C30H33BrFN3O5/c1-35(2)13-12-30(36,22-16-26(39-5)33-17-25(22)38-4)27(20-8-7-9-24(37-3)28(20)32)21-15-18-14-19(31)10-11-23(18)34-29(21)40-6/h7-11,14-17,27,36H,12-13H2,1-6H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human ERG by manual patch clamp electrophysiology assay


Bioorg Med Chem 27: 1283-1291 (2019)


Article DOI: 10.1016/j.bmc.2019.02.025
More data for this
Ligand-Target Pair