BindingDB logo
myBDB logout

null

SMILES: COCc1ccc(CNc2ncccn2)cc1

InChI Key: InChIKey=VSWKLQAOENCZFP-UHFFFAOYSA-N

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 = 194574   
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))		BDBM194574
PNG
(US9205085, MSX- 208)
Show SMILES COCc1ccc(CNc2ncccn2)cc1
Show InChI InChI=1S/C13H15N3O/c1-17-10-12-5-3-11(4-6-12)9-16-13-14-7-2-8-15-13/h2-8H,9-10H2,1H3,(H,14,15,16)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 100n/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