BDBM50327621 6-(3-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)propoxy)-7-methylisoindolin-1-one::CHEMBL1257736

SMILES: Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12

InChI Key: InChIKey=CZMNVXMBURYBAI-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 = 50327621   

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 1A (Homo sapiens (Human))	BDBM50327621 (6-(3-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)pr...) Show SMILES Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C26H28FN3O2/c1-18-24(9-6-20-17-28-26(31)25(18)20)32-15-3-10-29-11-13-30(14-12-29)23-5-2-4-19-16-21(27)7-8-22(19)23/h2,4-9,16H,3,10-15,17H2,1H3,(H,28,31)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.08	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
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50327621 (6-(3-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)pr...) Show SMILES Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C26H28FN3O2/c1-18-24(9-6-20-17-28-26(31)25(18)20)32-15-3-10-29-11-13-30(14-12-29)23-5-2-4-19-16-21(27)7-8-22(19)23/h2,4-9,16H,3,10-15,17H2,1H3,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70	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 2A (Homo sapiens (Human))	BDBM50327621 (6-(3-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)pr...) Show SMILES Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C26H28FN3O2/c1-18-24(9-6-20-17-28-26(31)25(18)20)32-15-3-10-29-11-13-30(14-12-29)23-5-2-4-19-16-21(27)7-8-22(19)23/h2,4-9,16H,3,10-15,17H2,1H3,(H,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12.5	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
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50327621 (6-(3-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)pr...) Show SMILES Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C26H28FN3O2/c1-18-24(9-6-20-17-28-26(31)25(18)20)32-15-3-10-29-11-13-30(14-12-29)23-5-2-4-19-16-21(27)7-8-22(19)23/h2,4-9,16H,3,10-15,17H2,1H3,(H,28,31)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21.4	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