BDBM50356472 CHEMBL1911862

SMILES: Nc1c(oc2ccccc12)C1=NC2(CN1)CN1CCC2CC1

InChI Key: InChIKey=DRTIPJHGTWRGMH-UHFFFAOYSA-N

Data: 1 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 2 hits for monomerid = 50356472   

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-7 (Rattus norvegicus (Rat))	BDBM50356472 (CHEMBL1911862) Show SMILES Nc1c(oc2ccccc12)C1=NC2(CN1)CN1CCC2CC1 |t:12,(17.47,-38.07,;17.87,-36.58,;16.89,-35.39,;17.73,-34.09,;19.22,-34.49,;20.51,-33.66,;21.87,-34.35,;21.96,-35.9,;20.66,-36.73,;19.3,-36.03,;15.35,-35.48,;14.51,-36.77,;13.03,-36.37,;12.95,-34.83,;14.38,-34.28,;13.03,-37.92,;11.7,-38.68,;10.37,-37.92,;10.37,-36.38,;11.7,-35.6,;12.45,-36.93,;11.11,-37.69,)| Show InChI InChI=1S/C17H20N4O/c18-14-12-3-1-2-4-13(12)22-15(14)16-19-9-17(20-16)10-21-7-5-11(17)6-8-21/h1-4,11H,5-10,18H2,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept Inc Curated by ChEMBL					Assay Description Displacement of [3H]-methyllycaconitine from alpha7 nAChR in rat hippocampal membranes after 2 hrs by liquid scintillation counting				Eur J Med Chem 46: 5625-35 (2011) Article DOI: 10.1016/j.ejmech.2011.09.033 BindingDB Entry DOI: 10.7270/Q2639Q4D
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Rattus norvegicus (Rat))	BDBM50356472 (CHEMBL1911862) Show SMILES Nc1c(oc2ccccc12)C1=NC2(CN1)CN1CCC2CC1 |t:12,(17.47,-38.07,;17.87,-36.58,;16.89,-35.39,;17.73,-34.09,;19.22,-34.49,;20.51,-33.66,;21.87,-34.35,;21.96,-35.9,;20.66,-36.73,;19.3,-36.03,;15.35,-35.48,;14.51,-36.77,;13.03,-36.37,;12.95,-34.83,;14.38,-34.28,;13.03,-37.92,;11.7,-38.68,;10.37,-37.92,;10.37,-36.38,;11.7,-35.6,;12.45,-36.93,;11.11,-37.69,)| Show InChI InChI=1S/C17H20N4O/c18-14-12-3-1-2-4-13(12)22-15(14)16-19-9-17(20-16)10-21-7-5-11(17)6-8-21/h1-4,11H,5-10,18H2,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
Targacept Inc Curated by ChEMBL					Assay Description Agonist activity at rat recombinant alpha7 nAChR expressed in GH4C1 cells by patch clamp technique				Eur J Med Chem 46: 5625-35 (2011) Article DOI: 10.1016/j.ejmech.2011.09.033 BindingDB Entry DOI: 10.7270/Q2639Q4D
					More data for this Ligand-Target Pair