BDBM79180 2-(2-aminoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester;benzenesulfonic acid::2-(2-aminoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester;besylic acid::AMLODIPINE::MLS001331726::SMR000814710::benzenesulfonic acid;3-O-ethyl 5-O-methyl 2-(2-aminoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate::benzenesulfonic acid;O3-ethyl O5-methyl 2-(2-azanylethoxymethyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate::cid_60496

SMILES CCOC(=O)C1=C(COCCN)N=C(C)C(C1c1ccccc1Cl)C(=O)OC

InChI Key InChIKey=YMDXSGBNCBQYGC-UHFFFAOYSA-N

Data  4 KI  3 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 7 hits for monomerid = 79180   

TargetUbiquitin-conjugating enzyme E2 N(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataIC50: 2.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetPotassium channel subfamily K member 2(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataIC50: 400nMAssay Description:Inhibition of TREK-1 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetATP-dependent translocase ABCB1(Human)
Kanazawa University

Curated by ChEMBL
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataIC50: 2.20E+4nMAssay Description:TP_TRANSPORTER: inhibition of Daunorubicin transepithelial transport (basal to apical) (Daunorubicin: 0.035 uM) in MDR1-expressing LLC-PK1 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/22/2013
Entry Details Article
PubMed
TargetVoltage-dependent L-type calcium channel subunit alpha-1C(Rat)
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataKi:  2nMAssay Description:Binding affinity against rat L-type calcium channelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/30/2012
Entry Details Article
PubMed
TargetAlpha-1A adrenergic receptor(Human)
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataKi:  2.34E+3nMAssay Description:Binding affinity against human Alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/30/2012
Entry Details Article
PubMed
TargetAlpha-1D adrenergic receptor(Human)
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataKi:  5.37E+3nMAssay Description:Binding affinity against human Alpha-1d adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/30/2012
Entry Details Article
PubMed
TargetAlpha-1B adrenergic receptor(Human)
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM79180(MLS001331726 | cid_60496 | benzenesulfonic acid;3-...)
Affinity DataKi:  7.94E+3nMAssay Description:Binding affinity against human Alpha-1b adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/30/2012
Entry Details Article
PubMed