BDBM50166083 CHEMBL191869::N-{3-[(3R,6R,9S,14S)-6-(3-Guanidino-propyl)-9-(4-hydroxy-benzyl)-14-naphthalen-2-ylmethyl-2,5,8,11-tetraoxo-1,4,7,10tetraaza-cyclotetradec-3-yl]-propyl}-guanidine

SMILES NC(=N)NCCC[C@H]1NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CC[C@@H](Cc2ccc3ccccc3c2)NC1=O

InChI Key InChIKey=MMACXAIBJOUIOH-XQVPNCLKSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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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 = 50166083   

TargetC-X-C chemokine receptor type 4(Homo sapiens (Human))
Kyoto University

Curated by ChEMBL
LigandPNGBDBM50166083(CHEMBL191869 | N-{3-[(3R,6R,9S,14S)-6-(3-Guanidino...)
Affinity DataIC50: >1.00E+3nMAssay Description:Inhibition of [125I]-SDF-1 binding to C-X-C chemokine receptor type 4 (CXCR4) expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed