BDBM50229064 CHEMBL159839

SMILES: OC(=O)C(O)=O.CN1CCC=C(C1)c1nc(no1)C1CCC1

InChI Key: InChIKey=HTDIFLGHYUHKNP-UHFFFAOYSA-N

Data: 2 IC50  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 = 50229064   

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 (Homo sapiens (Human))	BDBM50229064 (CHEMBL159839) Show SMILES OC(=O)C(O)=O.CN1CCC=C(C1)c1nc(no1)C1CCC1 |c:9| Show InChI InChI=1S/C12H17N3O/c1-15-7-3-6-10(8-15)12-13-11(14-16-12)9-4-2-5-9/h6,9H,2-5,7-8H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
Ferrosan A/S Curated by ChEMBL					Assay Description Agonist activity at muscarinic acetylcholine receptor in isolated guinea pig ileum.				J Med Chem 34: 687-92 (1991) BindingDB Entry DOI: 10.7270/Q2RN3B25
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50229064 (CHEMBL159839) Show SMILES OC(=O)C(O)=O.CN1CCC=C(C1)c1nc(no1)C1CCC1 |c:9| Show InChI InChI=1S/C12H17N3O/c1-15-7-3-6-10(8-15)12-13-11(14-16-12)9-4-2-5-9/h6,9H,2-5,7-8H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	191	n/a	n/a	n/a	n/a	n/a	n/a
Ferrosan A/S Curated by ChEMBL					Assay Description In vitro binding affinity to muscarinic acetylcholine receptor site in rat brain assayed using [3H]oxotremorine-M as the radioligand.				J Med Chem 34: 687-92 (1991) BindingDB Entry DOI: 10.7270/Q2RN3B25
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50229064 (CHEMBL159839) Show SMILES OC(=O)C(O)=O.CN1CCC=C(C1)c1nc(no1)C1CCC1 |c:9| Show InChI InChI=1S/C12H17N3O/c1-15-7-3-6-10(8-15)12-13-11(14-16-12)9-4-2-5-9/h6,9H,2-5,7-8H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ferrosan A/S Curated by ChEMBL					Assay Description In Vitro binding affinity to the muscarinic acetylcholine receptor site in rat brain by using [3H]QNB as the radioligand.				J Med Chem 34: 687-92 (1991) BindingDB Entry DOI: 10.7270/Q2RN3B25
					More data for this Ligand-Target Pair