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BDBM50340712 (E,E)-N,N'-bis[[4-[[2-[[(4-amino-2-methylquinolin-6-yl)amino]carbonyl]phenyl]methoxy]phenyl]methylene]-1,6-hexanediamine::CHEMBL1762376

SMILES: Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(\C=N\CCCCCC\N=C\c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1

InChI Key: InChIKey=IPVPCJVFYARXLY-UBLZWTTJSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50340712   
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
Nociceptin receptor


(Homo sapiens (Human))
BDBM50340712
PNG
((E,E)-N,N'-bis[[4-[[2-[[(4-amino-2-methylquinolin-...)
Show SMILES Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(\C=N\CCCCCC\N=C\c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1
Show InChI InChI=1S/C56H54N8O4/c1-37-29-51(57)49-31-43(19-25-53(49)61-37)63-55(65)47-13-7-5-11-41(47)35-67-45-21-15-39(16-22-45)33-59-27-9-3-4-10-28-60-34-40-17-23-46(24-18-40)68-36-42-12-6-8-14-48(42)56(66)64-44-20-26-54-50(32-44)52(58)30-38(2)62-54/h5-8,11-26,29-34H,3-4,9-10,27-28,35-36H2,1-2H3,(H2,57,61)(H2,58,62)(H,63,65)(H,64,66)/b59-33+,60-34+
PDB

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Article
PubMed
n/an/a 83.3n/an/an/an/an/an/a



Istituto Superiore di Sanit£

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr14-nociceptin from human NOP receptor expressed in human HEK293 cells after 2 hrs by scintillation counting


Eur J Med Chem 46: 1207-21 (2011)


Article DOI: 10.1016/j.ejmech.2011.01.040
BindingDB Entry DOI: 10.7270/Q2NK3FBC
More data for this
Ligand-Target Pair