BDBM50441713 CHEMBL2435856

SMILES CCc1nc(Oc2ccc(cc2)C(O)=O)ccc1CN1CCC(CC1)N1[C@@H](CN(C2CCOCC2)C1=O)c1ccccc1

InChI Key InChIKey=FJAGYOZYOQUDEQ-UHFFFAOYSA-N

Data  8 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50441713   

TargetC-C chemokine receptor type 5(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 0.700nMAssay Description:Inhibition of CCR5 (unknown origin) expressed in human HeLa cells assessed as inhibition of interaction of CHO cells expressing HIV-1 JRFLenv and HIV...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetC-C chemokine receptor type 4(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 5.00E+3nMAssay Description:Antagonist activity at CCR4 (unknown origin) expressed in HEK293F cell membranes assessed as inhibition of TARC-induced calcium flux preincubated for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCytochrome P450 2C8(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of CYP2C8 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of CYP2C9 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of CYP2C19 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of CYP2D6 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of CYP1A2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCytochrome P450 2B6(Human)
Sanofi

Curated by ChEMBL
LigandPNGBDBM50441713(CHEMBL2435856)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of CYP2B6 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed