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BDBM121400 US8722709, 3

SMILES: NC(=O)Nc1cc(ccn1)-c1cc(nn1C1CCCC1)C(F)(F)F

InChI Key: InChIKey=OMPZQLVLVXBTLO-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 = 121400   
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))
BDBM121400
PNG
(US8722709, 3)
Show SMILES NC(=O)Nc1cc(ccn1)-c1cc(nn1C1CCCC1)C(F)(F)F
Show InChI InChI=1S/C15H16F3N5O/c16-15(17,18)12-8-11(23(22-12)10-3-1-2-4-10)9-5-6-20-13(7-9)21-14(19)24/h5-8,10H,1-4H2,(H3,19,20,21,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 4.20E+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