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SMILES: Fc1cccc(NCc2ccc(CNc3ncccn3)cc2)n1

InChI Key: InChIKey=KDLZUFWRBSILHT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 194583   
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
C-X-C chemokine receptor type 4


(Rattus norvegicus (Rat))		BDBM194583
PNG
(US9205085, MSX- 222)
Show SMILES Fc1cccc(NCc2ccc(CNc3ncccn3)cc2)n1
Show InChI InChI=1S/C17H16FN5/c18-15-3-1-4-16(23-15)21-11-13-5-7-14(8-6-13)12-22-17-19-9-2-10-20-17/h1-10H,11-12H2,(H,21,23)(H,19,20,22)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 1n/an/an/an/an/an/a



Emory University

US Patent


Assay Description
A synthetic 14-mer peptide, TN14003, was previously reported to block both SDF-1/CXCR4 mediated invasion in vitro and metastasis in vivo with a high ...

US Patent US9205085 (2015)


BindingDB Entry DOI: 10.7270/Q2FF3R5M
More data for this
Ligand-Target Pair