BDBM50406538 CHEMBL4171125

SMILES: Clc1ccc(Nc2ccc(cn2)N2CC3CC(C2)N3)cc1Cl

InChI Key: InChIKey=MZBXNOWXAZNDIQ-UHFFFAOYSA-N

Data: 3 KI

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 = 50406538   

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 (Rattus norvegicus (Rat))	BDBM50406538 (CHEMBL4171125) Show SMILES Clc1ccc(Nc2ccc(cn2)N2CC3CC(C2)N3)cc1Cl |TLB:9:12:18:15| Show InChI InChI=1S/C16H16Cl2N4/c17-14-3-1-10(6-15(14)18)21-16-4-2-13(7-19-16)22-8-11-5-12(9-22)20-11/h1-4,6-7,11-12,20H,5,8-9H2,(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Chimica Biomolecolare Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in rat hippocampal membranes				Eur J Med Chem 152: 401-416 (2018) Article DOI: 10.1016/j.ejmech.2018.04.026 BindingDB Entry DOI: 10.7270/Q2930WQM
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50406538 (CHEMBL4171125) Show SMILES Clc1ccc(Nc2ccc(cn2)N2CC3CC(C2)N3)cc1Cl |TLB:9:12:18:15| Show InChI InChI=1S/C16H16Cl2N4/c17-14-3-1-10(6-15(14)18)21-16-4-2-13(7-19-16)22-8-11-5-12(9-22)20-11/h1-4,6-7,11-12,20H,5,8-9H2,(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Chimica Biomolecolare Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cortex membranes				Eur J Med Chem 152: 401-416 (2018) Article DOI: 10.1016/j.ejmech.2018.04.026 BindingDB Entry DOI: 10.7270/Q2930WQM
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor; alpha3/beta4 (Homo sapiens (Human))	BDBM50406538 (CHEMBL4171125) Show SMILES Clc1ccc(Nc2ccc(cn2)N2CC3CC(C2)N3)cc1Cl |TLB:9:12:18:15| Show InChI InChI=1S/C16H16Cl2N4/c17-14-3-1-10(6-15(14)18)21-16-4-2-13(7-19-16)22-8-11-5-12(9-22)20-11/h1-4,6-7,11-12,20H,5,8-9H2,(H,19,21)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Chimica Biomolecolare Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from human alpha3beta4 nAChR expressed in HEK293 cell membranes				Eur J Med Chem 152: 401-416 (2018) Article DOI: 10.1016/j.ejmech.2018.04.026 BindingDB Entry DOI: 10.7270/Q2930WQM
					More data for this Ligand-Target Pair