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BDBM121416 US8722709, 19

SMILES: NC(=O)Nc1cc(ccn1)-c1ccnn1-c1cccc(F)c1

InChI Key: InChIKey=RRHVPTRNEKZKBT-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 121416   
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
Mineralocorticoid receptor (MR)


(Homo sapiens (Human))
BDBM121416
PNG
(US8722709, 19)
Show SMILES NC(=O)Nc1cc(ccn1)-c1ccnn1-c1cccc(F)c1
Show InChI InChI=1S/C15H12FN5O/c16-11-2-1-3-12(9-11)21-13(5-7-19-21)10-4-6-18-14(8-10)20-15(17)22/h1-9H,(H3,17,18,20,22)
PDB
MMDB

KEGG

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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 310n/an/an/an/a7.4n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The MR competitive binding assay is based on the binding and displacement of a TAMRA-labeled Dexamethasone probe with fluorescence polarization (FP) ...


US Patent US8722709 (2014)


BindingDB Entry DOI: 10.7270/Q2NS0SJ4
More data for this
Ligand-Target Pair