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BDBM50203591 CHEMBL396821::[8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-8H-1,3a,7,8-tetraaza-cyclopenta[a]inden-3-ylmethyl]-methyl-(2-pyridin-2-yl-ethyl)-amine

SMILES: CN(CCc1ccccn1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12

InChI Key: InChIKey=IRWPFZHJKZQNRC-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50203591   
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))		BDBM50203591
PNG
(CHEMBL396821 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(CCc1ccccn1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(5.34,.35,;6.34,-.82,;7.85,-.56,;8.38,.89,;7.39,2.07,;5.89,1.8,;4.9,2.98,;5.43,4.43,;6.95,4.69,;7.93,3.51,;5.81,-2.27,;6.8,-3.44,;6.43,-4.94,;5.01,-5.52,;7.74,-5.75,;8.92,-4.76,;10.46,-4.65,;11.45,-5.84,;12.96,-5.57,;13.48,-4.12,;13.95,-6.74,;13.42,-8.2,;14.41,-9.37,;11.9,-8.46,;10.91,-7.28,;9.4,-7.54,;10.83,-3.17,;12.2,-2.44,;12.26,-.9,;10.88,-.01,;9.58,-.8,;9.52,-2.34,;8.34,-3.33,)|
Show InChI InChI=1S/C26H27ClN6/c1-17-14-18(2)24(21(27)15-17)33-25-22(9-7-12-29-25)32-23(19(3)30-26(32)33)16-31(4)13-10-20-8-5-6-11-28-20/h5-9,11-12,14-15H,10,13,16H2,1-4H3
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Article
PubMed
 2.80E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production

Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair