BDBM50327618 5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)butoxy)isoindolin-1-one::CHEMBL1258881

SMILES: Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1

InChI Key: InChIKey=KGJDHBDNYIVRSF-UHFFFAOYSA-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 = 50327618   

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
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50327618 (5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...) Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1 Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.891	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells				Bioorg Med Chem Lett 20: 5666-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.023 BindingDB Entry DOI: 10.7270/Q2HH6K9S
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50327618 (5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...) Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1 Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay				Bioorg Med Chem Lett 20: 5666-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.023 BindingDB Entry DOI: 10.7270/Q2HH6K9S
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50327618 (5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...) Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1 Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells				Bioorg Med Chem Lett 20: 5666-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.023 BindingDB Entry DOI: 10.7270/Q2HH6K9S
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50327618 (5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...) Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1 Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells by scintillation proximity assay				Bioorg Med Chem Lett 20: 5666-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.023 BindingDB Entry DOI: 10.7270/Q2HH6K9S
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50327618 (5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...) Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1 Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to human 5HT2A receptor				Bioorg Med Chem Lett 20: 5666-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.023 BindingDB Entry DOI: 10.7270/Q2HH6K9S
					More data for this Ligand-Target Pair