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BDBM329784 Preparation of 6-(4-chlorophenyl)-8-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-4H-[1,2,4]triazolo[4,3-a][1]benzazepine::US9663523, Example 48

SMILES: Cc1nnc(CC2C=C(c3ccc(Cl)cc3)c3cc(ccc3-n3c(C)nnc23)-c2c(C)noc2C)o1

InChI Key: InChIKey=VBNLIRSQBFUZDN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 329784   
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))
BDBM329784
PNG
(Preparation of 6-(4-chlorophenyl)-8-(3,5-dimethyl-...)
Show SMILES Cc1nnc(CC2C=C(c3ccc(Cl)cc3)c3cc(ccc3-n3c(C)nnc23)-c2c(C)noc2C)o1 |t:7|
Show InChI InChI=1S/C27H23ClN6O2/c1-14-26(15(2)36-33-14)19-7-10-24-23(11-19)22(18-5-8-21(28)9-6-18)12-20(13-25-31-30-17(4)35-25)27-32-29-16(3)34(24)27/h5-12,20H,13H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 340n/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