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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific demethylase 4C' and Ligand = 'BDBM50149915'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM50149915
PNG
(CHEMBL3769669)
Show SMILES COc1cccc(Cn2cc(Oc3nc4cnccc4c(=O)[nH]3)cn2)c1
Show InChI InChI=1S/C27H23BrN6O5S/c28-19-7-10-24(31-16-19)34-25(35)15-22(33-26(36)18-11-13-30-14-12-18)27(37)32-20-8-5-17(6-9-20)21-3-1-2-4-23(21)40(29,38)39/h1-14,16,22H,15H2,(H,32,37)(H,33,36)(H2,29,38,39)(H,31,34,35)
PDB

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 631n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of N-terminal his-tagged human KDM4C expressed in Escherichia coli BL21(DE3) using trimethylated peptide substrate by RFMS assay


J Med Chem 59: 1370-87 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01538
BindingDB Entry DOI: 10.7270/Q26D5VV2
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM50149915
PNG
(CHEMBL3769669)
Show SMILES COc1cccc(Cn2cc(Oc3nc4cnccc4c(=O)[nH]3)cn2)c1
Show InChI InChI=1S/C27H23BrN6O5S/c28-19-7-10-24(31-16-19)34-25(35)15-22(33-26(36)18-11-13-30-14-12-18)27(37)32-20-8-5-17(6-9-20)21-3-1-2-4-23(21)40(29,38)39/h1-14,16,22H,15H2,(H,32,37)(H,33,36)(H2,29,38,39)(H,31,34,35)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.31E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of N-terminal his-tagged full-length human KDM4C transfected in U2OS cells assessed as inhibition of H3K9Me3 demethylation for 24 hrs


J Med Chem 59: 1370-87 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01538
BindingDB Entry DOI: 10.7270/Q26D5VV2
More data for this
Ligand-Target Pair