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SMILES: Cc1ccc2cccnc2c1NC(=O)[C@H]1CC[C@@H](CC1)N1C(=O)[C@H]2[C@@H]3C[C@@H](C=C3)[C@H]2C1=O

InChI Key: InChIKey=HPDUWGRLSICIEG-JXUYPSSRSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50294829   
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
Proto-oncogene Wnt-3


(Homo sapiens (Human))		BDBM50294829
PNG
(4-((1R,2S,6R,7S)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0*...)
Show SMILES Cc1ccc2cccnc2c1NC(=O)[C@H]1CC[C@@H](CC1)N1C(=O)[C@H]2[C@@H]3C[C@@H](C=C3)[C@H]2C1=O |r,wU:24.27,26.28,14.15,wD:23.25,29.34,17.22,c:30,(24.21,-7.63,;24.97,-8.97,;26.52,-8.98,;27.29,-10.31,;26.52,-11.64,;27.29,-12.97,;26.52,-14.31,;24.97,-14.31,;24.2,-12.98,;24.97,-11.64,;24.2,-10.3,;22.66,-10.3,;21.89,-8.97,;22.66,-7.63,;20.35,-8.96,;19.58,-10.3,;18.04,-10.3,;17.27,-8.95,;18.04,-7.62,;19.58,-7.63,;15.73,-8.95,;14.82,-7.72,;15.3,-6.25,;13.36,-8.19,;12.03,-7.42,;12.42,-8.91,;12,-10.39,;10.69,-9.72,;10.69,-8.18,;13.35,-9.73,;14.82,-10.21,;15.29,-11.68,)|
Show InChI InChI=1S/C26H27N3O3/c1-14-4-5-15-3-2-12-27-23(15)22(14)28-24(30)16-8-10-19(11-9-16)29-25(31)20-17-6-7-18(13-17)21(20)26(29)32/h2-7,12,16-21H,8-11,13H2,1H3,(H,28,30)/t16-,17-,18+,19-,20-,21+
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Similars
Article
PubMed
n/an/an/an/a 1.00E+3n/an/an/an/a



The University of Texas Southwestern Medical Center at Dallas

Curated by ChEMBL


Assay Description
Inhibition of Wnt3 expressed in mouse L-cells assessed as inhibition of Wnt/catanin signaling pathway by luciferase reporter gene assay

Bioorg Med Chem Lett 19: 3825-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.040
BindingDB Entry DOI: 10.7270/Q2DZ08BS
More data for this
Ligand-Target Pair