BDBM50156325 CHEMBL188790::N-arylpiperazine derivative

SMILES: COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1cccc(NC(NCCNC2CCN(CC2)c2ccccc2)=NC#N)c1

InChI Key: InChIKey=BWFMAHSAXMNUMG-UHFFFAOYSA-N

Data: 1 IC50

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 = 50156325   

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
Neuropeptide Y receptor type 1 (Homo sapiens (Human))	BDBM50156325 (CHEMBL188790 | N-arylpiperazine derivative) Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1cccc(NC(NCCNC2CCN(CC2)c2ccccc2)=NC#N)c1 |w:39.42,c:13,t:10| Show InChI InChI=1S/C32H39N7O4/c1-21-27(30(40)42-3)29(28(22(2)37-21)31(41)43-4)23-9-8-10-25(19-23)38-32(36-20-33)35-16-15-34-24-13-17-39(18-14-24)26-11-6-5-7-12-26/h5-12,19,24,27,29,34H,13-18H2,1-4H3,(H2,35,36,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-PYY to membranes of SK-N-MC cells expressing the human Y1 receptors				Bioorg Med Chem Lett 14: 5975-8 (2004) Article DOI: 10.1016/j.bmcl.2004.10.005 BindingDB Entry DOI: 10.7270/Q2765DTG
					More data for this Ligand-Target Pair