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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50236468   
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 histone demethylase 1A/REST corepressor 1


(Homo sapiens (Human))		BDBM50236468
PNG
(CHEMBL4061143)
Show SMILES CCOCc1cccc(NC(=O)c2cc3sccc3n2C)c1COc1ccc(OC2CCNCC2)cc1
Show InChI InChI=1S/C29H33N3O4S/c1-3-34-18-20-5-4-6-25(31-29(33)27-17-28-26(32(27)2)13-16-37-28)24(20)19-35-21-7-9-22(10-8-21)36-23-11-14-30-15-12-23/h4-10,13,16-17,23,30H,3,11-12,14-15,18-19H2,1-2H3,(H,31,33)
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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 56n/an/an/an/an/an/a



European Institute of Oncology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human KDM1A/CoREST complex expressed in Escherichia coli using [Lys(Me1)4]-Histone H3 (1 to 21 residues)-GGK(biotin) as sub...

J Med Chem 60: 1693-1715 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01019
BindingDB Entry DOI: 10.7270/Q22809VX
More data for this
Ligand-Target Pair