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SMILES: CCOC(=O)N1C2CCC1CC(C2)c1ccnc2c(c(nn12)-c1ccncc1)-c1ccc(cc1)-c1nnco1

InChI Key: InChIKey=WODFQKKZUUBQPI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50303105   
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
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM50303105
PNG
(CHEMBL583340 | ethyl 3-(3-(4-(1,3,4-oxadiazol-2-yl...)
Show SMILES CCOC(=O)N1C2CCC1CC(C2)c1ccnc2c(c(nn12)-c1ccncc1)-c1ccc(cc1)-c1nnco1 |THB:13:11:5:7.8|
Show InChI InChI=1S/C29H27N7O3/c1-2-38-29(37)35-22-7-8-23(35)16-21(15-22)24-11-14-31-27-25(26(34-36(24)27)19-9-12-30-13-10-19)18-3-5-20(6-4-18)28-33-32-17-39-28/h3-6,9-14,17,21-23H,2,7-8,15-16H2,1H3
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n/an/a 151n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of B-Raf

Bioorg Med Chem Lett 19: 6957-61 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.058
BindingDB Entry DOI: 10.7270/Q2833S34
More data for this
Ligand-Target Pair