BDBM50096540 (2S)-2-(3-chlorophenyl)-1-[(N-methyl-N-phenylsulfonyl)amino]-4-[spiro(2,3-dihydrobenzthiophene-3,40-piperidin-10-yl)]butane S-oxide::1'-[3-(3-chlorophenyl)-4-methyl(phenyl)sulfonamido-(3S)-butyl]spiro[2,3-dihydrobenzo[b]thiophene-1-oxide-3,4'-(hexahydropyridine)]::1-oxo-1'-[3-(3-chlorophenyl)-4-methyl(phenyl)sulfonamido-(3S)-butyl]spiro[2,3-dihydrobenzo[b]thiophene-3,4'-(hexahydropyridine)]::Analogue of 1-[N-(Methyl)-N-(phenylsulfonyl)amino]-2-(phenyl)-4-[4-(substituted)piperidin-1-yl]butane::CHEMBL83338::N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-benzothiophene-3,4-piperidin-1-yl)]-butyl}-N-methyl-benzenesulfonamide

SMILES CN(C[C@@H](CCN1CCC2(CS(=O)c3ccccc23)CC1)c1cccc(Cl)c1)S(=O)(=O)c1ccccc1

InChI Key InChIKey=ITHOBZKJMFCARD-UHFFFAOYSA-N

Data  10 IC50

  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 10 hits for monomerid = 50096540   

TargetC-C chemokine receptor type 3(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 1.00E+4nMAssay Description:Compound concentration that causes 50 % inhibition of binding of specific radioligand to human CCR3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 4(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 1.00E+4nMAssay Description:Compound concentration that causes 50 % inhibition of binding of specific radioligand to human CCR4 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 1.00E+4nMAssay Description:Compound concentration that causes 50 % inhibition of binding of specific radioligand to human CCR1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 2(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 1.00E+4nMAssay Description:Compound concentration that causes 50 % inhibition of binding of specific radioligand to human CCR2 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 10nMAssay Description:Inhibitory activity against specific binding of [125I]-MIP-1 alpha to human CCR5 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 10nMAssay Description:Inhibition of [125I]-MIP-1 alpha binding to human CCR5 receptor expressed in Chinese hamster ovary (CHO) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 10nMAssay Description:Inhibition of [125I]-MIP-1 alpha binding to human CCR5 receptor expressed in Chinese hamster ovary (CHO) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 10nMAssay Description:Binding affinity against C-C chemokine receptor type 5 stably expressed in Chinese hamster ovary (CHO) cells using [125I]-MIP-1 alpha as the radiolig...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 35nMAssay Description:Binding affinity against human CCR5 receptor stably expressed in Chinese hamster ovary (CHO) cells using [125I]-MIP-1 alpha as the radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50096540(N-{(S)-2-(3-chloro-phenyl)-4-[4-(1-oxo-spiro-(1-be...)
Affinity DataIC50: 700nMAssay Description:Antagonist activity at Homo sapiens (human) CCR5 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2020
Entry Details Article