Compounds in cluster

5 similar compounds to monomer 50056147

Wt: 178.2
BDBM50450746

Wt: 206.2
BDBM50056148

Wt: 206.2
BDBM50056149

Wt: 192.2
BDBM50056150

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Wt: 206.2
BDBM50069826

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50450746,50056148,50056149,50056150,50069826
Target (Institution)	Ligand	Target Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50069826 (2-Methyl-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-p...) Show SMILES CN1CCC[C@H]1COc1ccc(C)nc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars AffyNet	PubMed	1.26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity towards nAChR (alpha4-beta2) by the displacement of [3H]-(-)-cytisine in whole rat brain membranes.				Bioorg Med Chem Lett 8: 249-54 (1999)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50450746 (CHEMBL441069) Show SMILES Cc1ncccc1OC[C@@H]1CCN1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars AffyNet	PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity towards Nicotinic acetylcholine receptor alpha4-beta2 in rat brain using [3H]-cytisine as radioligand				Bioorg Med Chem Lett 8: 2797-802 (1999)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50056148 (2-Methyl-3-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-p...) Show SMILES CN1CCC[C@H]1COc1cccnc1C Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars AffyNet	PubMed	22.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity towards nAChR (alpha4-beta2) by the displacement of [3H]-(-)-cytisine in whole rat brain membranes.				Bioorg Med Chem Lett 8: 249-54 (1999)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Homo sapiens (human))	BDBM50056149 (2-Methyl-3-((R)-1-methyl-pyrrolidin-2-ylmethoxy)-p...) Show SMILES CN1CCC[C@@H]1COc1cccnc1C Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars AffyNet	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [125I]-alpha-bungarotoxin from K-28 cells stably express human Nicotinic...				J Med Chem 40: 385-90 (1997)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Homo sapiens (human))	BDBM50056150 (2-Methyl-3-((R)-1-pyrrolidin-2-ylmethoxy)-pyridine...) Show SMILES Cc1ncccc1OC[C@H]1CCCN1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars AffyNet	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [125I]-alpha-bungarotoxin from K-28 cells stably express human Nicotinic...				J Med Chem 40: 385-90 (1997)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Homo sapiens (human))	BDBM50056148 (2-Methyl-3-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-p...) Show SMILES CN1CCC[C@H]1COc1cccnc1C Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars AffyNet	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [125I]-alpha-bungarotoxin from K-28 cells stably express human Nicotinic...				J Med Chem 40: 385-90 (1997)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Homo sapiens (Human)-Homo sapiens (human))	BDBM50069826 (2-Methyl-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-p...) Show SMILES CN1CCC[C@H]1COc1ccc(C)nc1 Show InChI	UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars AffyNet	PubMed	n/a	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Stimulation of cation efflux in human nAChR alpha4-beta2 expressing K177 cells				Bioorg Med Chem Lett 8: 249-54 (1999)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Homo sapiens (Human)-Homo sapiens (human))	BDBM50056148 (2-Methyl-3-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-p...) Show SMILES CN1CCC[C@H]1COc1cccnc1C Show InChI	UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars AffyNet	PubMed	n/a	n/a	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Stimulation of cation efflux in human nAChR alpha4-beta2 expressing K177 cells				Bioorg Med Chem Lett 8: 249-54 (1999)
Abbott Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair