BDBM91606 alpha7 agonists 6

SMILES: C[N+](C)(C)CCn1cc(COc2cc([O])nc3ccccc23)nn1

InChI Key: InChIKey=GLOKSQMAWAKLDX-UHFFFAOYSA-N

Data: 2 KI  1 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 91606   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuronal acetylcholine receptor subunit alpha-4 (Homo sapiens (Human))	BDBM91606 (alpha7 agonists 6) Show SMILES C[N+](C)(C)CCn1cc(COc2cc([O])nc3ccccc23)nn1 |^1:14| Show InChI InChI=1S/C17H21N5O2/c1-22(2,3)9-8-21-11-13(19-20-21)12-24-16-10-17(23)18-15-7-5-4-6-14(15)16/h4-7,10-11H,8-9,12H2,1-3H3/q+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.40E+4	-6.88	n/a	n/a	n/a	n/a	n/a	7.4	37
University of California, San Diego					Assay Description Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...				Taylor Research Group (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
5-HT3A Serotonin Receptor (Mus musculus (house mouse))	BDBM91606 (alpha7 agonists 6) Show SMILES C[N+](C)(C)CCn1cc(COc2cc([O])nc3ccccc23)nn1 |^1:14| Show InChI InChI=1S/C17H21N5O2/c1-22(2,3)9-8-21-11-13(19-20-21)12-24-16-10-17(23)18-15-7-5-4-6-14(15)16/h4-7,10-11H,8-9,12H2,1-3H3/q+1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>3.00E+4	>-6.41	n/a	n/a	n/a	n/a	n/a	7.4	37
University of California, San Diego					Assay Description Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...				Taylor Research Group (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Homo sapiens (Human))	BDBM91606 (alpha7 agonists 6) Show SMILES C[N+](C)(C)CCn1cc(COc2cc([O])nc3ccccc23)nn1 |^1:14| Show InChI InChI=1S/C17H21N5O2/c1-22(2,3)9-8-21-11-13(19-20-21)12-24-16-10-17(23)18-15-7-5-4-6-14(15)16/h4-7,10-11H,8-9,12H2,1-3H3/q+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.70E+3	n/a	n/a	7.4	37
University of California, San Diego					Assay Description Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...				Taylor Research Group (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair