BDBM50123078 2-{5-[4-(1H-Indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-pentyl}-isoindole-1,3-dione::CHEMBL414433

SMILES: O=C1N(CCCCCN2CCC(=CC2)c2c[nH]c3ccccc23)C(=O)c2ccccc12

InChI Key: InChIKey=MBMKBYGCQNWXCQ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50123078   

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
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50123078 (2-{5-[4-(1H-Indol-3-yl)-3,6-dihydro-2H-pyridin-1-y...) Show SMILES O=C1N(CCCCCN2CCC(=CC2)c2c[nH]c3ccccc23)C(=O)c2ccccc12 |c:11| Show InChI InChI=1S/C26H27N3O2/c30-25-21-9-2-3-10-22(21)26(31)29(25)15-7-1-6-14-28-16-12-19(13-17-28)23-18-27-24-11-5-4-8-20(23)24/h2-5,8-12,18,27H,1,6-7,13-17H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description In vitro binding affinity for serotonin reuptake sites in rat frontal cortex membranes by [3H]-paroxetine displacement.				Bioorg Med Chem Lett 13: 405-8 (2003) BindingDB Entry DOI: 10.7270/Q2Z89BSX
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50123078 (2-{5-[4-(1H-Indol-3-yl)-3,6-dihydro-2H-pyridin-1-y...) Show SMILES O=C1N(CCCCCN2CCC(=CC2)c2c[nH]c3ccccc23)C(=O)c2ccccc12 |c:11| Show InChI InChI=1S/C26H27N3O2/c30-25-21-9-2-3-10-22(21)26(31)29(25)15-7-1-6-14-28-16-12-19(13-17-28)23-18-27-24-11-5-4-8-20(23)24/h2-5,8-12,18,27H,1,6-7,13-17H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description In vitro binding affinity at human cloned dopamine receptor D2 (long) stably expressed in CHO cells by [3H]-Spiperone displacement.				Bioorg Med Chem Lett 13: 405-8 (2003) BindingDB Entry DOI: 10.7270/Q2Z89BSX
					More data for this Ligand-Target Pair