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BDBM131875 US8835444, 4.6

SMILES: CC(C)c1cc(C)nn1C[C@H]1CC[C@@H](CC1)NC(=O)c1cc(Cl)cnc1C

InChI Key: InChIKey=VFTPTHOIZIMBGU-SAABIXHNSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 131875   
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))		BDBM131875
PNG
(US8835444, 4.6)
Show SMILES CC(C)c1cc(C)nn1C[C@H]1CC[C@@H](CC1)NC(=O)c1cc(Cl)cnc1C |r,wU:10.10,wD:13.17,(4.54,-2.18,;4.14,-.7,;2.66,-.3,;5.23,.39,;6.77,.39,;7.25,1.86,;8.58,2.63,;6,2.76,;4.76,1.86,;3.42,2.63,;2.09,1.86,;2.09,.32,;.75,-.45,;-.58,.32,;-.58,1.86,;.75,2.63,;-1.91,-.45,;-3.25,.32,;-3.25,1.86,;-4.58,-.45,;-5.91,.32,;-7.25,-.45,;-8.58,.32,;-7.25,-1.99,;-5.91,-2.76,;-4.58,-1.99,;-3.25,-2.76,)|
Show InChI InChI=1S/C21H29ClN4O/c1-13(2)20-9-14(3)25-26(20)12-16-5-7-18(8-6-16)24-21(27)19-10-17(22)11-23-15(19)4/h9-11,13,16,18H,5-8,12H2,1-4H3,(H,24,27)/t16-,18-
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Similars
US Patent
n/an/a 40n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Chinese hamster ovary (CHO) cells expressing either the human or rat recombinant CRF-1 or human CRF-2alpha (Chen et al, Proc Natl Acad Sci USA 90, 89...

US Patent US8835444 (2014)


BindingDB Entry DOI: 10.7270/Q28K77ST
More data for this
Ligand-Target Pair