BDBM50147121 3-(4-Pyridin-3-ylmethyl-piperazin-1-yl)-propan-1-ol::CHEMBL105901

SMILES: OCCCN1CCN(Cc2cccnc2)CC1

InChI Key: InChIKey=ZNGNTGGTDXMFJR-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50147121   

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
Creatine transporter (Rattus norvegicus)	BDBM50147121 (3-(4-Pyridin-3-ylmethyl-piperazin-1-yl)-propan-1-o...) Show SMILES OCCCN1CCN(Cc2cccnc2)CC1 Show InChI InChI=1S/C13H21N3O/c17-10-2-5-15-6-8-16(9-7-15)12-13-3-1-4-14-11-13/h1,3-4,11,17H,2,5-10,12H2	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Texas Tech University Health Sciences Center Curated by ChEMBL					Assay Description Inhibition of [3H]-choline brain uptake was determined by in situ brain perfusion studies in male rats				Bioorg Med Chem Lett 14: 3085-92 (2004) Article DOI: 10.1016/j.bmcl.2004.04.020 BindingDB Entry DOI: 10.7270/Q2BG2PJR
					More data for this Ligand-Target Pair