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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bromodomain-containing protein 4' and Ligand = 'BDBM329791'   
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
Bromodomain-containing protein 4


(Homo sapiens (Human))		BDBM329791
PNG
(Preparation of 2-{[(4R)-6-(4-chlorophenyl)-1-methy...)
Show SMILES Cc1nnc2[C@H](CC(=O)N3CCN4C(CCC4=O)C3)C=C(c3ccc(Cl)cc3)c3cc(OC(F)(F)F)ccc3-n12 |r,t:21|
Show InChI InChI=1S/C28H25ClF3N5O3/c1-16-33-34-27-18(13-26(39)35-10-11-36-20(15-35)6-9-25(36)38)12-22(17-2-4-19(29)5-3-17)23-14-21(40-28(30,31)32)7-8-24(23)37(16)27/h2-5,7-8,12,14,18,20H,6,9-11,13,15H2,1H3/t18-,20?/m0/s1
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US Patent
n/an/a 180n/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