BDBM50213070 CHEMBL405426

SMILES: C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(Cl)cc1

InChI Key: InChIKey=WIEJREPGMVWDKC-XNSDCXBGSA-N

Data: 2 IC50

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 = 50213070   

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
Muscarinic acetylcholine receptor (RAT)	BDBM50213070 (CHEMBL405426) Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(Cl)cc1 |THB:5:6:12:10.9| Show InChI InChI=1S/C18H19ClN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	0.450	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.				Citation and Details BindingDB Entry DOI: 10.7270/Q23B628P
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50213070 (CHEMBL405426) Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(Cl)cc1 |THB:5:6:12:10.9| Show InChI InChI=1S/C18H19ClN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...				Citation and Details BindingDB Entry DOI: 10.7270/Q23B628P
					More data for this Ligand-Target Pair