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BDBM195068 US9670211, 14-1

SMILES: O[C@H]1C[C@H](C1)n1c(CN2C(=O)C3(CC3)c3ccncc23)nc2cc(Cl)ccc12

InChI Key: InChIKey=NJUODCKGZFFLJP-OKILXGFUSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 195068   
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
Major surface glycoprotein G


(Human respiratory syncytial virus A (strain Long))		BDBM195068
PNG
(US9670211, 14-1 )
Show SMILES O[C@H]1C[C@H](C1)n1c(CN2C(=O)C3(CC3)c3ccncc23)nc2cc(Cl)ccc12 |r,wU:3.5,1.0,(.71,6.09,;.31,4.61,;1.08,3.27,;-.25,2.5,;-1.02,3.84,;-.65,1.01,;.25,-.23,;1.79,-.23,;2.56,-1.57,;4.1,-1.57,;4.87,-.23,;4.58,-3.03,;5.35,-4.36,;6.12,-3.03,;3.33,-3.94,;3.17,-5.47,;1.76,-6.09,;.52,-5.19,;.68,-3.66,;2.09,-3.03,;-.65,-1.48,;-2.12,-1,;-3.45,-1.77,;-4.78,-1,;-6.12,-1.77,;-4.78,.54,;-3.45,1.31,;-2.12,.54,)|
Show InChI InChI=1S/C21H19ClN4O2/c22-12-1-2-17-16(7-12)24-19(26(17)13-8-14(27)9-13)11-25-18-10-23-6-3-15(18)21(4-5-21)20(25)28/h1-3,6-7,10,13-14,27H,4-5,8-9,11H2/t13-,14+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
To measure anti-RSV activity of compounds, 96-well plates are seeded with 6×103 cells per well in Dulbecco's modified Eagle's medium (DMEM) c...

US Patent US9670211 (2017)


BindingDB Entry DOI: 10.7270/Q2C827GQ
More data for this
Ligand-Target Pair