BDBM50538063 CHEMBL4642118

SMILES [H][C@]12C[C@@]1([H])N[C@H](COc1ccc(Cl)nc1)C2

InChI Key InChIKey=PYSCVJMLJRHJGJ-UHFFFAOYSA-N

Data  2 KI  4 IC50  2 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 8 hits for monomerid = 50538063   

TargetNeuronal acetylcholine receptor subunit alpha-4/beta-2(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataKi:  1.5nMAssay Description:Displacement of [3H]cytisine from human alpha4beta2 nAChR expressed in CHOK1 cell membrane by microbeta scintillation counting methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetNeuronal acetylcholine receptor subunit alpha-4/beta-2(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataIC50: 7.31E+3nMAssay Description:Antagonist activity at alpha4beta2 nAChR (unknown origin) expressed in HEK293 cells assessed as reduction in acetylcholine-induced currents at -80 mV...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of recombinant human ERG expressed in HEK293 at -80 mV holding potential by whole-cell patch clamp methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetNeuronal acetylcholine receptor subunit alpha-3/beta-4(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]epibatidine from human alpha3beta4 nAChR expressed in IMR32 cell membrane by microbeta scintillation counting methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataIC50: 3.81E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate incubated for 12 min in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataIC50: 4.50E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate incubated for 2 min in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetNeuronal acetylcholine receptor subunit alpha-4/beta-2(Rat)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataEC50:  2.59E+5nMAssay Description:In vivo receptor occupancy at alpha4beta2 nAChR in Wistar rat assessed as plasma concentration pretreated for 15 mins followed by non radiolabelled Z...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetNeuronal acetylcholine receptor subunit alpha-4/beta-2(Rat)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50538063(CHEMBL4642118)
Affinity DataEC50:  3.34E+5nMAssay Description:In vivo receptor occupancy at alpha4beta2 nAChR in Wistar rat assessed as brain concentration pretreated for 15 mins followed by non radiolabelled ZW...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed