BDBM50149711 5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-amide::CHEMBL182652

SMILES: COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1

InChI Key: InChIKey=HBYKTDPONPUZPO-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50149711   

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(3) dopamine receptor (Homo sapiens (Human))	BDBM50149711 (5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methox...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1 Show InChI InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards human D3 receptor using [3H]-spiperone expressed in CHO cells				Bioorg Med Chem Lett 14: 3963-6 (2004) Article DOI: 10.1016/j.bmcl.2004.05.052 BindingDB Entry DOI: 10.7270/Q2B27TQD
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50149711 (5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methox...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1 Show InChI InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards 5-HT1A receptor from porcine cortical membranes using [3H]-8-OH-DPAT				Bioorg Med Chem Lett 14: 3963-6 (2004) Article DOI: 10.1016/j.bmcl.2004.05.052 BindingDB Entry DOI: 10.7270/Q2B27TQD
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50149711 (5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methox...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1 Show InChI InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards human D4.4 receptor using [3H]-spiperone expressed in CHO cells				Bioorg Med Chem Lett 14: 3963-6 (2004) Article DOI: 10.1016/j.bmcl.2004.05.052 BindingDB Entry DOI: 10.7270/Q2B27TQD
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50149711 (5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methox...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1 Show InChI InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards human D2 short receptor using [3H]-spiperone expressed in CHO cells				Bioorg Med Chem Lett 14: 3963-6 (2004) Article DOI: 10.1016/j.bmcl.2004.05.052 BindingDB Entry DOI: 10.7270/Q2B27TQD
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50149711 (5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methox...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1 Show InChI InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards human D2 long receptor using [3H]-spiperone expressed in CHO cells				Bioorg Med Chem Lett 14: 3963-6 (2004) Article DOI: 10.1016/j.bmcl.2004.05.052 BindingDB Entry DOI: 10.7270/Q2B27TQD
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Sus scrofa)	BDBM50149711 (5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methox...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(I)s2)CC1 Show InChI InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards D1 receptor from porcine striatal membranes using [3H]-SCH- 23390				Bioorg Med Chem Lett 14: 3963-6 (2004) Article DOI: 10.1016/j.bmcl.2004.05.052 BindingDB Entry DOI: 10.7270/Q2B27TQD
					More data for this Ligand-Target Pair