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SMILES: CC(C)N(Cc1ccccc1)c1cc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C

InChI Key: InChIKey=NZGVRMGNONAOPJ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50152166   
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
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))		BDBM50152166
PNG
(Benzyl-[3-(6-dimethylamino-4-methyl-pyridin-3-yl)-...)
Show SMILES CC(C)N(Cc1ccccc1)c1cc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C |(5.75,1.7,;4.72,.54,;5.21,-.92,;3.22,.86,;2.74,2.33,;3.74,3.47,;3.27,4.94,;4.28,6.07,;5.79,5.76,;6.28,4.29,;5.26,3.15,;2.19,-.29,;2.67,-1.75,;1.64,-2.9,;2.13,-4.36,;.15,-2.57,;-.34,-1.13,;-1.74,-.51,;-1.59,1.03,;-2.75,2.05,;-.09,1.35,;.68,.02,;-3.07,-1.27,;-3.07,-2.83,;-4.4,-3.6,;-5.73,-2.83,;-5.73,-1.29,;-4.4,-.51,;-4.41,1.03,;-7.07,-3.6,;-8.4,-2.83,;-7.07,-5.14,)|
Show InChI InChI=1S/C26H32N6/c1-17(2)31(16-21-11-9-8-10-12-21)24-14-19(4)28-26-25(20(5)29-32(24)26)22-15-27-23(30(6)7)13-18(22)3/h8-15,17H,16H2,1-7H3
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Article
PubMed
 11n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [125I]-o-CRF binding to CHO cells expressing human CRF1 receptor

J Med Chem 47: 4787-98 (2004)


Article DOI: 10.1021/jm040058e
BindingDB Entry DOI: 10.7270/Q2N29WDR
More data for this
Ligand-Target Pair