BDBM50561917 CHEMBL4789939

SMILES CNC(=O)COCC(=O)NCCCCNC(=O)COCC(=O)NC[C@H]1CC[C@@H](CC1)\N=C(/NC1CCCCC1)SCC1=CSC2=NC(C)(C)CN12

InChI Key InChIKey=CFYAXNRXEOCJSZ-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50561917   

TargetC-X-C chemokine receptor type 4(Human)
Virginia Commonwealth University

Curated by ChEMBL
LigandPNGBDBM50561917(CHEMBL4789939)
Affinity DataIC50: 6.90E+4nMAssay Description:Displacement of [125I]SDF-1alpha from CXCR4 in human Chem-1 cells measured after 90 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetC-X-C chemokine receptor type 4(Human)
Virginia Commonwealth University

Curated by ChEMBL
LigandPNGBDBM50561917(CHEMBL4789939)
Affinity DataIC50: 5.30E+4nMAssay Description:Antagonist activity at CXCR4 (unknown origin) expressed in CHO cells assessed as reduction in SDF1-induced intracellular calcium mobilization incubat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Virginia Commonwealth University

Curated by ChEMBL
LigandPNGBDBM50561917(CHEMBL4789939)
Affinity DataEC50:  1.45E+5nMAssay Description:Inhibition of HIV1 3B reverse transcriptase infected in human GHOST CXCR4 cells assessed as reduction in viral replication incubated for 60 to 90 min...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed