BDBM50477626 CHEMBL437007::QF-4124B

SMILES: Cn1ncc2c1CC(CN1CCC(CC1)C(=O)c1ccc(F)cc1)CC2=O

InChI Key: InChIKey=OJJQKWWWAKJKCJ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50477626   

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))	BDBM50477626 (CHEMBL437007 | QF-4124B) Show SMILES Cn1ncc2c1CC(CN1CCC(CC1)C(=O)c1ccc(F)cc1)CC2=O Show InChI InChI=1S/C21H24FN3O2/c1-24-19-10-14(11-20(26)18(19)12-23-24)13-25-8-6-16(7-9-25)21(27)15-2-4-17(22)5-3-15/h2-5,12,14,16H,6-11,13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Compostela Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin human cloned serotonin 5HT2A receptor				Bioorg Med Chem Lett 17: 4873-7 (2007) Article DOI: 10.1016/j.bmcl.2007.06.045 BindingDB Entry DOI: 10.7270/Q2J38WCB
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50477626 (CHEMBL437007 | QF-4124B) Show SMILES Cn1ncc2c1CC(CN1CCC(CC1)C(=O)c1ccc(F)cc1)CC2=O Show InChI InChI=1S/C21H24FN3O2/c1-24-19-10-14(11-20(26)18(19)12-23-24)13-25-8-6-16(7-9-25)21(27)15-2-4-17(22)5-3-15/h2-5,12,14,16H,6-11,13H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Compostela Curated by ChEMBL					Assay Description Displacement of [3H]mesulergine human cloned serotonin 5HT2C receptor				Bioorg Med Chem Lett 17: 4873-7 (2007) Article DOI: 10.1016/j.bmcl.2007.06.045 BindingDB Entry DOI: 10.7270/Q2J38WCB
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50477626 (CHEMBL437007 | QF-4124B) Show SMILES Cn1ncc2c1CC(CN1CCC(CC1)C(=O)c1ccc(F)cc1)CC2=O Show InChI InChI=1S/C21H24FN3O2/c1-24-19-10-14(11-20(26)18(19)12-23-24)13-25-8-6-16(7-9-25)21(27)15-2-4-17(22)5-3-15/h2-5,12,14,16H,6-11,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Compostela Curated by ChEMBL					Assay Description Displacement of [3H]spiperone human cloned dopamine D2 receptor				Bioorg Med Chem Lett 17: 4873-7 (2007) Article DOI: 10.1016/j.bmcl.2007.06.045 BindingDB Entry DOI: 10.7270/Q2J38WCB
					More data for this Ligand-Target Pair