BDBM50407772 CHEMBL418678

SMILES: Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1

InChI Key: InChIKey=ANJGZJUIHVVPCI-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50407772   

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 3a (5-HT3a)/3b (5-HT3b) receptor (Rattus norvegicus-RAT)	BDBM50407772 (CHEMBL418678) Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1 Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Caen Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 3 receptor				J Med Chem 39: 2068-80 (1996) Article DOI: 10.1021/jm950543x BindingDB Entry DOI: 10.7270/Q2T72JNC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50407772 (CHEMBL418678) Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1 Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Caen Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 2C receptor				J Med Chem 39: 2068-80 (1996) Article DOI: 10.1021/jm950543x BindingDB Entry DOI: 10.7270/Q2T72JNC
					More data for this Ligand-Target Pair
Serotonin 1d (5-HT1d) receptor (Sus scrofa)	BDBM50407772 (CHEMBL418678) Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1 Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.38E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Caen Curated by ChEMBL					Assay Description Binding affinity for 5-hydroxytryptamine 1D receptor				J Med Chem 39: 2068-80 (1996) Article DOI: 10.1021/jm950543x BindingDB Entry DOI: 10.7270/Q2T72JNC
					More data for this Ligand-Target Pair
Serotonin 1B/1D receptor (Rattus norvegicus (Rat))	BDBM50407772 (CHEMBL418678) Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1 Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Caen Curated by ChEMBL					Assay Description Binding affinity for 5-hydroxytryptamine 1B receptor				J Med Chem 39: 2068-80 (1996) Article DOI: 10.1021/jm950543x BindingDB Entry DOI: 10.7270/Q2T72JNC
					More data for this Ligand-Target Pair
Serotonin 2a (5-HT2a) receptor (BOVINE)	BDBM50407772 (CHEMBL418678) Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1 Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Caen Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 2A receptor				J Med Chem 39: 2068-80 (1996) Article DOI: 10.1021/jm950543x BindingDB Entry DOI: 10.7270/Q2T72JNC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50407772 (CHEMBL418678) Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1 Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	347	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Caen Curated by ChEMBL					Assay Description Binding affinity for 5-hydroxytryptamine 1A receptor				J Med Chem 39: 2068-80 (1996) Article DOI: 10.1021/jm950543x BindingDB Entry DOI: 10.7270/Q2T72JNC
					More data for this Ligand-Target Pair