BDBM83450 ALFENTANIL::Alfentanil hydrochloride::MLS002320667::N-[1-[2-(4-ethyl-5-keto-tetrazol-1-yl)ethyl]-4-(methoxymethyl)-4-piperidyl]-N-phenyl-propionamide;hydrochloride::N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)ethyl]-4-(methoxymethyl)piperidin-4-yl]-N-phenyl-propanamide;hydrochloride::N-[1-[2-(4-ethyl-5-oxo-1-tetrazolyl)ethyl]-4-(methoxymethyl)-4-piperidinyl]-N-phenylpropanamide;hydrochloride::N-[1-[2-(4-ethyl-5-oxotetrazol-1-yl)ethyl]-4-(methoxymethyl)piperidin-4-yl]-N-phenylpropanamide;hydrochloride::SMR001338813::cid_64761

SMILES CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2nnn(CC)c2=O)CC1

InChI Key InChIKey=IDBPHNDTYPBSNI-UHFFFAOYSA-N

Data  2 KI  4 IC50  1 EC50

  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 6 hits for monomerid = 83450   

LigandChemical structure of BindingDB Monomer ID 83450BDBM83450(N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-...)
Affinity DataKi:  8.20nMAssay Description:In vitro affinity to displace [3H]naloxone from opiate receptor in freshly prepared rat brain homogenatesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/7/2019
Entry Details Article
PubMed
TargetMu-type opioid receptor(Rat)
Anaquest Pharmaceuticals

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 83450BDBM83450(N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-...)
Affinity DataKi:  8.20nMAssay Description:Ability to displace [3H]naloxone from the Opioid receptor mu 1 isolated from the rat brain membranes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
Anaquest

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 83450BDBM83450(N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-...)
Affinity DataIC50: 15nMAssay Description:In vitro binding activity against opioid receptor mu using [3H]DAGO) as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
Anaquest

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 83450BDBM83450(N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-...)
Affinity DataIC50: 1.00E+4nMAssay Description:In vitro binding activity against opioid receptor kappa using [3H]EKC as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetATP-dependent translocase ABCB1(Human)
Vanderbilt University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 83450BDBM83450(N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-...)
Affinity DataIC50: 1.12E+5nMAssay Description:TP_TRANSPORTER: inhibition of Digoxin transepithelial transport (basal to apical) (Digoxin: 5 uM) in Caco-2 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/22/2013
Entry Details Article
PubMed
TargetBile salt export pump(Human)
Amgen

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 83450BDBM83450(N-[1-[2-(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-...)
Affinity DataIC50: 1.35E+5nMAssay Description:Inhibition of human BSEP expressed in fall armyworm sf9 cell plasma membrane vesicles assessed as reduction in vesicle-associated [3H]-taurocholate t...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2019
Entry Details Article
PubMed