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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Corticotropin-releasing factor receptor 1' and Ligand = 'BDBM50116101'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50116101
PNG
(CHEMBL304059 | [1-Ethyl-5-methyl-3-(2,4,6-trimethy...)
Show SMILES CCCN(CCC)c1nc(C)nc2c(nn(CC)c12)-c1c(C)cc(C)cc1C |(-1.18,4.5,;-2.52,3.77,;-2.56,2.23,;-3.91,1.49,;-5.22,2.28,;-5.19,3.82,;-6.51,4.61,;-3.93,-.05,;-5.29,-.8,;-5.32,-2.34,;-6.66,-3.09,;-4,-3.13,;-2.65,-2.39,;-1.18,-2.9,;-.25,-1.66,;-1.14,-.4,;-.65,1.07,;.87,1.35,;-2.61,-.85,;-.74,-4.37,;.75,-4.7,;1.8,-3.57,;1.22,-6.17,;.16,-7.31,;.61,-8.78,;-1.35,-6.96,;-1.79,-5.49,;-3.28,-5.14,)|
Show InChI InChI=1S/C23H33N5/c1-8-11-27(12-9-2)23-22-21(24-18(7)25-23)20(26-28(22)10-3)19-16(5)13-15(4)14-17(19)6/h13-14H,8-12H2,1-7H3
PDB
MMDB

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Similars

PubMed
15n/an/an/an/an/an/an/an/a



Neurogen Corporation

Curated by ChEMBL


Assay Description
Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 12: 2133-6 (2002)


BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
More data for this
Ligand-Target Pair