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SMILES: COc1ccccc1NCc1ccc(CNc2ccccc2OC)cc1

InChI Key: InChIKey=WNFNQMUNWPRXKU-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 194572   
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))		BDBM194572
PNG
(US9205085, MSX- 206)
Show SMILES COc1ccccc1NCc1ccc(CNc2ccccc2OC)cc1
Show InChI InChI=1S/C22H24N2O2/c1-25-21-9-5-3-7-19(21)23-15-17-11-13-18(14-12-17)16-24-20-8-4-6-10-22(20)26-2/h3-14,23-24H,15-16H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 10n/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