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SMILES: CCCN(Cc1cccc(OC)c1)c1cc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C

InChI Key: InChIKey=IIQOPKAHPHUWDS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50152181   
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))		BDBM50152181
PNG
(CHEMBL364214 | [3-(6-Dimethylamino-4-methyl-pyridi...)
Show SMILES CCCN(Cc1cccc(OC)c1)c1cc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C |(6.44,-1.62,;4.93,-1.31,;4.45,.16,;2.93,.47,;2.46,1.93,;3.47,3.09,;4.99,2.77,;6.02,3.92,;5.53,5.37,;4.01,5.7,;3.52,7.15,;4.54,8.3,;2.98,4.54,;1.9,-.69,;2.39,-2.15,;1.36,-3.3,;1.86,-4.77,;-.13,-2.98,;-.62,-1.52,;-2.03,-.9,;-1.89,.63,;-3.03,1.66,;-.37,.96,;.41,-.37,;-3.36,-1.68,;-3.36,-3.23,;-4.69,-4,;-6.02,-3.23,;-6.02,-1.68,;-4.69,-.91,;-4.72,.63,;-7.38,-4,;-8.71,-3.23,;-7.38,-5.54,)|
Show InChI InChI=1S/C27H34N6O/c1-8-12-32(17-21-10-9-11-22(15-21)34-7)25-14-19(3)29-27-26(20(4)30-33(25)27)23-16-28-24(31(5)6)13-18(23)2/h9-11,13-16H,8,12,17H2,1-7H3
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Article
PubMed
 24n/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