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BDBM121419 US8722709, 22

SMILES: NC(=O)Nc1cc(ccn1)-c1ccnn1Cc1ccc(F)cc1

InChI Key: InChIKey=BDCWJRVRBALYGS-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 121419   
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


(Homo sapiens (Human))
BDBM121419
PNG
(US8722709, 22)
Show SMILES NC(=O)Nc1cc(ccn1)-c1ccnn1Cc1ccc(F)cc1
Show InChI InChI=1S/C16H14FN5O/c17-13-3-1-11(2-4-13)10-22-14(6-8-20-22)12-5-7-19-15(9-12)21-16(18)23/h1-9H,10H2,(H3,18,19,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 2.40E+3n/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