BDBM50228585 CHEMBL111087

SMILES: [H][C@]1(CCCN1C(=O)OC)C#CCN1CCCC1

InChI Key: InChIKey=OPAUHIRZERWWPD-GFCCVEGCSA-N

Data: 5 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 5 hits for monomerid = 50228585   

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)	BDBM50228585 (CHEMBL111087) Show SMILES [H][C@]1(CCCN1C(=O)OC)C#CCN1CCCC1 Show InChI InChI=1S/C13H20N2O2/c1-17-13(16)15-11-5-7-12(15)6-4-10-14-8-2-3-9-14/h12H,2-3,5,7-11H2,1H3/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	620	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
American Cyanamid Company Curated by ChEMBL					Assay Description Binding activity against Muscarinic acetylcholine receptor in rat cortex, using [3H]QNB as a radioligand.				J Med Chem 33: 3190-8 (1990) BindingDB Entry DOI: 10.7270/Q2M32Z0K
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50228585 (CHEMBL111087) Show SMILES [H][C@]1(CCCN1C(=O)OC)C#CCN1CCCC1 Show InChI InChI=1S/C13H20N2O2/c1-17-13(16)15-11-5-7-12(15)6-4-10-14-8-2-3-9-14/h12H,2-3,5,7-11H2,1H3/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.44E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
American Cyanamid Company Curated by ChEMBL					Assay Description Binding activity to the muscarinic acetylcholine receptor in rat cortex, assayed using [3H]CD as a radioligand.				J Med Chem 33: 3190-8 (1990) BindingDB Entry DOI: 10.7270/Q2M32Z0K
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50228585 (CHEMBL111087) Show SMILES [H][C@]1(CCCN1C(=O)OC)C#CCN1CCCC1 Show InChI InChI=1S/C13H20N2O2/c1-17-13(16)15-11-5-7-12(15)6-4-10-14-8-2-3-9-14/h12H,2-3,5,7-11H2,1H3/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
American Cyanamid Company Curated by ChEMBL					Assay Description Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay				J Med Chem 33: 3190-8 (1990) BindingDB Entry DOI: 10.7270/Q2M32Z0K
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50228585 (CHEMBL111087) Show SMILES [H][C@]1(CCCN1C(=O)OC)C#CCN1CCCC1 Show InChI InChI=1S/C13H20N2O2/c1-17-13(16)15-11-5-7-12(15)6-4-10-14-8-2-3-9-14/h12H,2-3,5,7-11H2,1H3/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.42E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
American Cyanamid Company Curated by ChEMBL					Assay Description Binding activity to muscarinic acetylcholine receptor in rat heart, assayed using [3H]-QNB as a radioligand.				J Med Chem 33: 3190-8 (1990) BindingDB Entry DOI: 10.7270/Q2M32Z0K
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50228585 (CHEMBL111087) Show SMILES [H][C@]1(CCCN1C(=O)OC)C#CCN1CCCC1 Show InChI InChI=1S/C13H20N2O2/c1-17-13(16)15-11-5-7-12(15)6-4-10-14-8-2-3-9-14/h12H,2-3,5,7-11H2,1H3/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.75E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
American Cyanamid Company Curated by ChEMBL					Assay Description Binding activity to muscarinic acetylcholine receptor in rat heart, assayed using [3H]QNB as a radioligand in the presence of Gpp(NH)p.				J Med Chem 33: 3190-8 (1990) BindingDB Entry DOI: 10.7270/Q2M32Z0K
					More data for this Ligand-Target Pair