BDBM50107736 CHEMBL3600816

SMILES: CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1

InChI Key: InChIKey=MGORRVRDTUOGIX-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50107736   

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
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50107736 (CHEMBL3600816) Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma GmbH& Co. KG Curated by ChEMBL					Assay Description Inhibition of 5HT2A receptor (unknown origin)				Bioorg Med Chem Lett 25: 3264-9 (2015) BindingDB Entry DOI: 10.7270/Q25D8TMB
					More data for this Ligand-Target Pair
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM50107736 (CHEMBL3600816) Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma GmbH& Co. KG Curated by ChEMBL					Assay Description Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method				Bioorg Med Chem Lett 25: 3264-9 (2015) BindingDB Entry DOI: 10.7270/Q25D8TMB
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50107736 (CHEMBL3600816) Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35)	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma GmbH& Co. KG Curated by ChEMBL					Assay Description Inhibition of muscarinic M1 receptor (unknown origin)				Bioorg Med Chem Lett 25: 3264-9 (2015) BindingDB Entry DOI: 10.7270/Q25D8TMB
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50107736 (CHEMBL3600816) Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma GmbH& Co. KG Curated by ChEMBL					Assay Description Inhibition of CYP2D6 receptor (unknown origin)				Bioorg Med Chem Lett 25: 3264-9 (2015) BindingDB Entry DOI: 10.7270/Q25D8TMB
					More data for this Ligand-Target Pair