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SMILES: Cc1nnc2C(CC(=O)N3CCS(=O)(=O)C3)C=C(c3ccc(Cl)cc3)c3ccccc3-n12

InChI Key: InChIKey=GTAIKSPNNVJEHK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 329766   
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
Bromodomain-containing protein 4


(Homo sapiens (Human))		BDBM329766
PNG
(Preparation of 2-[6-(4-chlorophenyl)-1-methyl-4H-[...)
Show SMILES Cc1nnc2C(CC(=O)N3CCS(=O)(=O)C3)C=C(c3ccc(Cl)cc3)c3ccccc3-n12 |t:17|
Show InChI InChI=1S/C23H21ClN4O3S/c1-15-25-26-23-17(13-22(29)27-10-11-32(30,31)14-27)12-20(16-6-8-18(24)9-7-16)19-4-2-3-5-21(19)28(15)23/h2-9,12,17H,10-11,13-14H2,1H3
PDB

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UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 80n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For this purpose, a time-resolved fluorescence resonance energy transfer (TR-FRET) assay was used, which measures the binding between N-terminally Hi...

US Patent US9663523 (2017)


BindingDB Entry DOI: 10.7270/Q2NC639V
More data for this
Ligand-Target Pair