BDBM114613 1-[(5-bromanylthiophen-2-yl)methyl]-4-pyridin-2-yl-piperazine::1-[(5-bromo-2-thienyl)methyl]-4-(2-pyridyl)piperazine::1-[(5-bromo-2-thiophenyl)methyl]-4-(2-pyridinyl)piperazine::1-[(5-bromothiophen-2-yl)methyl]-4-pyridin-2-ylpiperazine::SR-01000202086::SR-01000202086-3::cid_2838302

SMILES: Brc1ccc(CN2CCN(CC2)c2ccccn2)s1

InChI Key: InChIKey=YBLRRRKATMWSKQ-UHFFFAOYSA-N

Data: 2 EC50

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 = 114613   

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 2A (5HT2A) (Mus musculus (Mouse))	BDBM114613 (1-[(5-bromanylthiophen-2-yl)methyl]-4-pyridin-2-yl...) Show SMILES Brc1ccc(CN2CCN(CC2)c2ccccn2)s1 Show InChI InChI=1S/C14H16BrN3S/c15-13-5-4-12(19-13)11-17-7-9-18(10-8-17)14-3-1-2-6-16-14/h1-6H,7-11H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	7.61E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q24B2ZZ6
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM114613 (1-[(5-bromanylthiophen-2-yl)methyl]-4-pyridin-2-yl...) Show SMILES Brc1ccc(CN2CCN(CC2)c2ccccn2)s1 Show InChI InChI=1S/C14H16BrN3S/c15-13-5-4-12(19-13)11-17-7-9-18(10-8-17)14-3-1-2-6-16-14/h1-6H,7-11H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	9.25E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Assay Provider: Laura Bohn External Assay ID: OPRM1_AC...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2833QNG
					More data for this Ligand-Target Pair