BDBM50069017 1-(4-Fluoro-phenyl)-8,9-dimethoxy-4-methyl-3,4,5,6-tetrahydro-1H-azepino[3,4,5-cd]indole::CHEMBL366504

SMILES: COc1cc2CCN(C)Cc3cn(-c4ccc(F)cc4)c(c1OC)c23

InChI Key: InChIKey=WZSCCMIZBBXQBU-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50069017   

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
Serotonin 2 (5-HT2) receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50069017 (1-(4-Fluoro-phenyl)-8,9-dimethoxy-4-methyl-3,4,5,6...) Show SMILES COc1cc2CCN(C)Cc3cn(-c4ccc(F)cc4)c(c1OC)c23 Show InChI InChI=1S/C20H21FN2O2/c1-22-9-8-13-10-17(24-2)20(25-3)19-18(13)14(11-22)12-23(19)16-6-4-15(21)5-7-16/h4-7,10,12H,8-9,11H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Affinity for 5-hydroxytryptamine 2 receptor				Bioorg Med Chem Lett 8: 983-8 (1999) BindingDB Entry DOI: 10.7270/Q2Q81C7Z
					More data for this Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50069017 (1-(4-Fluoro-phenyl)-8,9-dimethoxy-4-methyl-3,4,5,6...) Show SMILES COc1cc2CCN(C)Cc3cn(-c4ccc(F)cc4)c(c1OC)c23 Show InChI InChI=1S/C20H21FN2O2/c1-22-9-8-13-10-17(24-2)20(25-3)19-18(13)14(11-22)12-23(19)16-6-4-15(21)5-7-16/h4-7,10,12H,8-9,11H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Affinity for alpha-1 adrenergic receptor				Bioorg Med Chem Lett 8: 983-8 (1999) BindingDB Entry DOI: 10.7270/Q2Q81C7Z
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50069017 (1-(4-Fluoro-phenyl)-8,9-dimethoxy-4-methyl-3,4,5,6...) Show SMILES COc1cc2CCN(C)Cc3cn(-c4ccc(F)cc4)c(c1OC)c23 Show InChI InChI=1S/C20H21FN2O2/c1-22-9-8-13-10-17(24-2)20(25-3)19-18(13)14(11-22)12-23(19)16-6-4-15(21)5-7-16/h4-7,10,12H,8-9,11H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Affinity for Dopamine receptor D2				Bioorg Med Chem Lett 8: 983-8 (1999) BindingDB Entry DOI: 10.7270/Q2Q81C7Z
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50069017 (1-(4-Fluoro-phenyl)-8,9-dimethoxy-4-methyl-3,4,5,6...) Show SMILES COc1cc2CCN(C)Cc3cn(-c4ccc(F)cc4)c(c1OC)c23 Show InChI InChI=1S/C20H21FN2O2/c1-22-9-8-13-10-17(24-2)20(25-3)19-18(13)14(11-22)12-23(19)16-6-4-15(21)5-7-16/h4-7,10,12H,8-9,11H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Affinity for Dopamine receptor D1				Bioorg Med Chem Lett 8: 983-8 (1999) BindingDB Entry DOI: 10.7270/Q2Q81C7Z
					More data for this Ligand-Target Pair