BDBM50322254 4-(4-bromophenyl)-1-((4-methoxy-1H-indol-3-yl)methyl)piperidin-4-ol::CHEMBL1170095

SMILES: COc1cccc2[nH]cc(CN3CCC(O)(CC3)c3ccc(Br)cc3)c12

InChI Key: InChIKey=YCAAJJCVIFKZBL-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 = 50322254   

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))	BDBM50322254 (4-(4-bromophenyl)-1-((4-methoxy-1H-indol-3-yl)meth...) Show SMILES COc1cccc2[nH]cc(CN3CCC(O)(CC3)c3ccc(Br)cc3)c12 Show InChI InChI=1S/C21H23BrN2O2/c1-26-19-4-2-3-18-20(19)15(13-23-18)14-24-11-9-21(25,10-12-24)16-5-7-17(22)8-6-16/h2-8,13,23,25H,9-12,14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cells after 60 mins by gamma counting				Bioorg Med Chem 18: 5291-300 (2010) Article DOI: 10.1016/j.bmc.2010.05.052 BindingDB Entry DOI: 10.7270/Q298880H
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50322254 (4-(4-bromophenyl)-1-((4-methoxy-1H-indol-3-yl)meth...) Show SMILES COc1cccc2[nH]cc(CN3CCC(O)(CC3)c3ccc(Br)cc3)c12 Show InChI InChI=1S/C21H23BrN2O2/c1-26-19-4-2-3-18-20(19)15(13-23-18)14-24-11-9-21(25,10-12-24)16-5-7-17(22)8-6-16/h2-8,13,23,25H,9-12,14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cells after 60 mins by gamma counting				Bioorg Med Chem 18: 5291-300 (2010) Article DOI: 10.1016/j.bmc.2010.05.052 BindingDB Entry DOI: 10.7270/Q298880H
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50322254 (4-(4-bromophenyl)-1-((4-methoxy-1H-indol-3-yl)meth...) Show SMILES COc1cccc2[nH]cc(CN3CCC(O)(CC3)c3ccc(Br)cc3)c12 Show InChI InChI=1S/C21H23BrN2O2/c1-26-19-4-2-3-18-20(19)15(13-23-18)14-24-11-9-21(25,10-12-24)16-5-7-17(22)8-6-16/h2-8,13,23,25H,9-12,14H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	840	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D4 receptor expressed in HEK293 cells after 60 mins by gamma counting				Bioorg Med Chem 18: 5291-300 (2010) Article DOI: 10.1016/j.bmc.2010.05.052 BindingDB Entry DOI: 10.7270/Q298880H
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50322254 (4-(4-bromophenyl)-1-((4-methoxy-1H-indol-3-yl)meth...) Show SMILES COc1cccc2[nH]cc(CN3CCC(O)(CC3)c3ccc(Br)cc3)c12 Show InChI InChI=1S/C21H23BrN2O2/c1-26-19-4-2-3-18-20(19)15(13-23-18)14-24-11-9-21(25,10-12-24)16-5-7-17(22)8-6-16/h2-8,13,23,25H,9-12,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.56E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 1 hr by liquid scintillation counting				Bioorg Med Chem 18: 5291-300 (2010) Article DOI: 10.1016/j.bmc.2010.05.052 BindingDB Entry DOI: 10.7270/Q298880H
					More data for this Ligand-Target Pair