BindingDB logo
myBDB logout

null

SMILES: CC(=O)NCC1CCN(Cc2cc(Oc3cnc(nc3)N3CCN(CC3)C3CC(C3)C(O)=O)nc(c2)-c2cc(Cl)cc(Cl)c2)CC1

InChI Key:

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 621464   
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
Furin [108-574]


(Homo sapiens (Human))		BDBM621464
PNG
(US11773078, Example 216)
Show SMILES CC(=O)NCC1CCN(Cc2cc(Oc3cnc(nc3)N3CCN(CC3)C3CC(C3)C(O)=O)nc(c2)-c2cc(Cl)cc(Cl)c2)CC1 |(14.28,-2.08,;12.95,-1.31,;12.95,.23,;11.61,-2.08,;10.28,-1.31,;8.94,-2.08,;8.94,-3.62,;7.61,-4.39,;6.28,-3.62,;4.94,-4.39,;3.61,-3.62,;2.28,-4.39,;.94,-3.62,;-.39,-4.39,;-1.72,-3.62,;-3.06,-4.39,;-4.39,-3.62,;-4.39,-2.08,;-3.06,-1.31,;-1.72,-2.08,;-5.73,-1.31,;-7.06,-2.08,;-8.39,-1.31,;-8.39,.23,;-7.06,1,;-5.73,.23,;-9.73,1,;-10.12,2.48,;-11.61,2.08,;-11.21,.6,;-12.95,2.85,;-14.28,2.08,;-12.95,4.39,;.94,-2.08,;2.28,-1.31,;3.61,-2.08,;2.28,.23,;.94,1,;.94,2.54,;-.39,3.31,;2.28,3.31,;3.61,2.54,;4.94,3.31,;3.61,1,;6.28,-2.08,;7.61,-1.31,)|
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 0.0630n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair